data_2cnp_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 2cnp _Structure_validation_residue.Date_analyzed 2016-10-07 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 ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.262 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -56.57 165.04 1.76 Allowed Pre-proline 0 CA--C 1.538 0.499 0 C-N-CA 124.651 1.18 . . . . 0.0 111.461 -179.556 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -44.03 -48.49 9.32 Favored 'Trans proline' 0 N--CA 1.458 -0.563 0 C-N-CA 123.805 3.004 . . . . 0.0 113.535 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.1 mt -53.39 -56.7 14.59 Favored 'General case' 0 C--O 1.226 -0.173 0 CA-C-N 117.66 0.209 . . . . 0.0 111.47 173.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -59.82 -41.78 92.05 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -174.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 tp-100 -60.47 -50.13 74.81 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.619 0.767 . . . . 0.0 110.437 176.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.31 -44.77 94.02 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.331 0.652 . . . . 0.0 111.213 -178.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 74.1 mt -52.41 -53.01 21.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 169.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.55 -47.97 17.24 Favored Glycine 0 CA--C 1.528 0.85 0 C-N-CA 125.254 1.406 . . . . 0.0 112.029 174.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 mt -56.77 -55.9 28.39 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 117.904 0.852 . . . . 0.0 111.051 174.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -56.92 -42.61 80.3 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 119.152 0.887 . . . . 0.0 111.318 -179.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 87.3 mt -57.11 -54.42 30.46 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 C-N-CA 123.305 0.642 . . . . 0.0 110.843 172.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.91 -49.87 64.32 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.211 -1.155 . . . . 0.0 110.211 -177.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 12.5 mm -52.48 -50.14 40.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 C-N-CA 124.027 0.931 . . . . 0.0 110.067 175.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -53.79 -62.29 1.75 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 121.346 0.593 . . . . 0.0 109.822 176.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -55.39 -35.12 64.98 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.001 0.92 . . . . 0.0 111.873 -173.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -48.7 -36.3 15.87 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.886 0.874 . . . . 0.0 111.659 176.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 56.3 m-85 -103.61 -56.43 2.21 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 123.125 0.57 . . . . 0.0 109.756 176.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.0 m . . . . . 0 C--O 1.227 -0.08 0 C-N-CA 123.533 0.733 . . . . 0.0 111.93 -176.792 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 69.5 p . . . . . 0 N--CA 1.452 -0.374 0 CA-C-O 120.884 0.373 . . . . 0.0 110.815 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.83 -171.73 3.21 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 125.952 1.701 . . . . 0.0 107.556 168.26 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 92.2 p -145.49 177.0 9.17 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 119.589 1.086 . . . . 0.0 112.672 -176.156 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -18.61 -64.64 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 130.919 3.687 . . . . 0.0 113.257 172.402 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.09 -53.23 59.57 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 123.918 0.887 . . . . 0.0 111.201 -178.016 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -61.87 -38.08 86.95 Favored 'General case' 0 C--O 1.222 -0.357 0 C-N-CA 123.077 0.551 . . . . 0.0 110.424 179.481 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 43.7 mt -64.81 -48.78 73.17 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 118.676 0.671 . . . . 0.0 110.979 178.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -57.69 -47.9 81.04 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 110.218 -0.29 . . . . 0.0 110.218 175.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -52.14 -59.14 4.72 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-O 119.396 -0.335 . . . . 0.0 110.695 172.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.3 mt -45.01 -61.53 1.59 Allowed 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 124.771 1.228 . . . . 0.0 110.551 -178.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 12.5 tt -62.08 -51.55 71.07 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 119.983 -0.687 . . . . 0.0 109.717 -174.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -61.88 -44.8 96.07 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.8 -0.562 . . . . 0.0 112.263 -174.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -75.12 -58.28 3.38 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 -177.545 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 18.0 mp0 -77.66 -18.82 56.32 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 117.634 -1.174 . . . . 0.0 113.305 -168.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 67.0 mt . . . . . 0 C--N 1.34 0.177 0 CA-C-N 120.133 1.333 . . . . 0.0 107.639 167.259 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 23.0 t70 . . . . . 0 CA--C 1.521 -0.15 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -34.89 -63.21 0.33 Allowed 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 125.144 1.378 . . . . 0.0 112.796 -178.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 67.4 tt0 -62.9 -37.01 85.22 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.327 0.651 . . . . 0.0 111.456 -174.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -62.37 -53.99 40.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 N-CA-C 105.868 -1.901 . . . . 0.0 105.868 -179.193 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 75.1 t -57.15 -41.19 77.36 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.606 0 CA-C-O 118.035 -0.983 . . . . 0.0 110.498 177.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.6 mmmt -58.18 -51.7 68.66 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 120.167 1.349 . . . . 0.0 110.192 176.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 49.5 mt -55.73 -43.77 76.9 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 119.162 -0.447 . . . . 0.0 110.925 179.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 22.1 mmt -67.15 -60.75 2.35 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 118.807 0.73 . . . . 0.0 109.624 178.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -42.73 -45.56 4.8 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 126.746 2.018 . . . . 0.0 111.213 -178.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -39.41 -47.79 1.84 Allowed 'General case' 0 C--O 1.234 0.252 0 C-N-CA 124.578 1.151 . . . . 0.0 112.36 178.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -57.99 -48.22 80.64 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-O 119.456 -0.307 . . . . 0.0 110.345 -178.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -71.02 -49.05 49.26 Favored 'General case' 0 C--O 1.227 -0.126 0 CA-C-N 118.14 0.427 . . . . 0.0 110.335 -178.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 54.5 ttt85 . . . . . 0 N--CA 1.456 -0.175 0 C-N-CA 124.788 1.235 . . . . 0.0 110.613 -178.97 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 22.2 mp0 . . . . . 0 CA--C 1.533 0.323 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.2 m -108.39 149.44 11.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 169.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 17.9 p30 -88.69 170.66 10.61 Favored 'General case' 0 C--O 1.23 0.077 0 C-N-CA 124.325 1.05 . . . . 0.0 110.832 175.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -38.58 -61.42 0.71 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.83 1.252 . . . . 0.0 113.74 174.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 40.8 tp60 -62.66 -38.75 91.54 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 120.025 1.284 . . . . 0.0 110.669 -174.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.85 -33.5 75.98 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.888 -0.507 . . . . 0.0 110.947 176.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -61.18 -53.27 59.11 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 118.841 0.746 . . . . 0.0 109.182 168.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 24.2 mm -52.24 -42.54 37.0 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 C-N-CA 122.844 0.458 . . . . 0.0 110.097 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 34.0 m -54.17 -37.76 64.81 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.049 0.54 . . . . 0.0 111.378 177.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -57.34 -50.18 73.78 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 176.026 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 51.5 mt -65.63 -43.65 88.86 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.186 0.595 . . . . 0.0 111.329 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.63 -43.41 97.97 Favored Glycine 0 CA--C 1.529 0.919 0 N-CA-C 110.945 -0.862 . . . . 0.0 110.945 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.81 -49.84 73.35 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 123.095 0.558 . . . . 0.0 110.383 175.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 16.4 tp -47.37 -56.48 6.81 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.401 0.619 . . . . 0.0 109.948 173.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.96 -53.57 39.77 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.555 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 9.2 mtm -57.46 -50.45 72.99 Favored 'General case' 0 N--CA 1.455 -0.203 0 O-C-N 123.327 0.392 . . . . 0.0 111.861 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 84.0 mt -63.41 -49.96 80.61 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-O 117.79 -1.1 . . . . 0.0 110.34 -174.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.467 0.4 OUTLIER -78.18 -40.36 37.97 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-N 120.256 1.389 . . . . 0.0 113.504 -178.508 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.0 m-80 -82.53 67.22 8.49 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 169.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 90.2 mt-10 -41.37 -42.64 2.29 Favored 'General case' 0 N--CA 1.461 0.099 0 C-N-CA 125.281 1.432 . . . . 0.0 112.12 -172.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -31.42 -52.75 0.22 Allowed 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 126.561 1.944 . . . . 0.0 113.372 171.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 63.8 mt . . . . . 0 C--O 1.224 -0.256 0 C-N-CA 123.717 0.807 . . . . 0.0 113.103 -175.157 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.274 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.3 m -57.54 165.91 1.99 Allowed Pre-proline 0 CA--C 1.537 0.477 0 C-N-CA 125.082 1.353 . . . . 0.0 111.109 179.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 99.1 Cg_exo -45.45 -47.53 12.96 Favored 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 123.524 2.816 . . . . 0.0 113.477 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.9 mt -54.39 -55.53 27.7 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-N 117.817 0.28 . . . . 0.0 111.435 173.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -59.43 -39.67 84.27 Favored 'General case' 0 C--O 1.225 -0.22 0 N-CA-C 110.385 -0.228 . . . . 0.0 110.385 -176.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 12.4 tp-100 -63.37 -50.41 70.04 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.507 0.723 . . . . 0.0 110.501 177.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.28 -45.03 93.34 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.313 0.645 . . . . 0.0 111.095 -178.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 72.7 mt -53.14 -53.23 23.79 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 N-CA-C 108.107 -1.071 . . . . 0.0 108.107 169.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.43 -45.86 16.82 Favored Glycine 0 CA--C 1.526 0.751 0 C-N-CA 125.69 1.614 . . . . 0.0 112.176 175.328 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.7 mt -57.87 -55.99 27.8 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 117.751 0.776 . . . . 0.0 110.97 173.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.6 mp -58.69 -43.02 89.85 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.18 0.9 . . . . 0.0 111.608 -179.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 75.0 mt -54.12 -57.23 6.34 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 C-N-CA 124.09 0.956 . . . . 0.0 109.981 171.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.02 -50.44 58.91 Favored Glycine 0 CA--C 1.522 0.497 0 N-CA-C 110.249 -1.14 . . . . 0.0 110.249 -176.019 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 13.9 mm -51.56 -50.28 30.55 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 C-N-CA 123.523 0.729 . . . . 0.0 110.04 175.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -56.9 -57.72 11.26 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.252 178.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -56.72 -38.44 72.35 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.843 0.857 . . . . 0.0 111.139 -174.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -46.09 -39.14 8.93 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.601 1.161 . . . . 0.0 111.571 -179.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -107.2 -52.01 2.83 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 122.542 0.337 . . . . 0.0 110.11 178.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 5.6 m . . . . . 0 CA--C 1.527 0.081 0 C-N-CA 123.573 0.749 . . . . 0.0 111.981 -177.01 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 19.9 t-160 . . . . . 0 N--CA 1.452 -0.347 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 56.9 p -125.58 157.94 35.88 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 125.162 1.385 . . . . 0.0 111.968 -172.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.88 178.44 9.4 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 125.372 1.469 . . . . 0.0 107.703 168.109 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 4.3 m -135.5 173.31 11.86 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.412 0.685 . . . . 0.0 112.793 -170.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 37.2 ttmt -19.52 -68.86 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 130.44 3.496 . . . . 0.0 113.824 175.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 3.0 tppp? -56.08 -53.55 55.67 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.586 0.755 . . . . 0.0 109.959 -175.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -57.04 -41.71 79.15 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 123.516 0.726 . . . . 0.0 110.989 178.524 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 39.4 mt -61.47 -50.05 74.33 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 118.478 0.581 . . . . 0.0 111.212 178.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -59.55 -47.7 84.51 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 179.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -50.71 -55.91 14.42 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.314 0.646 . . . . 0.0 111.403 171.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 3.1 mt -45.43 -65.25 0.56 Allowed 'General case' 0 CA--C 1.521 -0.151 0 C-N-CA 124.514 1.126 . . . . 0.0 110.994 176.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 14.8 tt -61.19 -47.61 92.75 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 C-N-CA 120.056 -0.658 . . . . 0.0 109.827 -173.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -53.94 -50.12 67.16 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.016 0.926 . . . . 0.0 111.866 -178.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 50.9 mtmt -76.21 -49.48 17.04 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 122.359 0.264 . . . . 0.0 111.076 -176.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -78.02 -32.44 51.04 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 118.533 -0.746 . . . . 0.0 112.795 -169.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 48.7 mt . . . . . 0 C--N 1.338 0.089 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 169.013 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 . . . . . 0 C--O 1.226 -0.149 0 N-CA-C 113.886 1.069 . . . . 0.0 113.886 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -30.3 -55.7 0.19 Allowed 'General case' 0 C--O 1.227 -0.102 0 C-N-CA 125.907 1.683 . . . . 0.0 113.695 178.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -66.1 -42.17 89.63 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 121.069 0.461 . . . . 0.0 110.701 -174.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.1 mp -61.26 -52.97 55.22 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 N-CA-C 106.636 -1.616 . . . . 0.0 106.636 179.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 69.9 t -57.08 -43.72 81.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 C-N-CA 124.362 1.065 . . . . 0.0 110.233 -178.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -55.92 -54.78 40.56 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 119.418 1.008 . . . . 0.0 110.497 172.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 43.5 mt -53.36 -42.09 66.49 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 119.04 -0.505 . . . . 0.0 111.359 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 22.9 mmt -68.76 -61.86 1.63 Allowed 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 118.741 0.701 . . . . 0.0 109.613 177.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -40.94 -46.98 2.92 Favored 'General case' 0 CA--C 1.516 -0.333 0 C-N-CA 127.626 2.37 . . . . 0.0 111.113 -177.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -39.71 -49.22 2.26 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.071 0.949 . . . . 0.0 112.513 177.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 10.0 mp -59.74 -56.02 27.05 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -177.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -61.27 -40.87 95.7 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 123.444 0.698 . . . . 0.0 111.245 -178.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 52.5 ttt180 -62.94 -50.54 70.4 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 124.035 0.934 . . . . 0.0 109.798 -178.559 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 . . . . . 0 C--O 1.227 -0.082 0 N-CA-C 110.586 -0.153 . . . . 0.0 110.586 -176.2 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 . . . . . 0 N--CA 1.453 -0.311 0 N-CA-C 110.378 -0.23 . . . . 0.0 110.378 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 12.0 m -115.67 148.03 18.67 Favored 'Isoleucine or valine' 0 C--O 1.235 0.303 0 N-CA-C 107.062 -1.459 . . . . 0.0 107.062 168.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -89.39 177.6 6.54 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.542 0.737 . . . . 0.0 111.287 175.251 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -47.35 -60.02 2.8 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.623 0.769 . . . . 0.0 111.94 175.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 40.3 tp60 -58.9 -37.93 77.75 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 119.218 0.917 . . . . 0.0 111.264 -176.029 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -63.26 -42.79 99.18 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.502 -0.749 . . . . 0.0 111.032 176.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -55.67 -48.59 74.79 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.64 -0.663 . . . . 0.0 109.915 170.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 28.0 mm -59.05 -32.47 47.89 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 O-C-N 121.601 -0.687 . . . . 0.0 110.76 175.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 23.4 m -66.37 -41.75 88.99 Favored 'General case' 0 C--O 1.225 -0.189 0 O-C-N 121.265 -0.897 . . . . 0.0 109.822 174.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -56.3 -52.92 62.74 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 174.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 49.2 mt -60.07 -46.13 90.59 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 120.933 0.397 . . . . 0.0 111.664 177.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.28 -39.2 97.58 Favored Glycine 0 CA--C 1.525 0.662 0 N-CA-C 110.948 -0.861 . . . . 0.0 110.948 -176.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.33 -47.14 77.54 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.431 0.692 . . . . 0.0 110.175 174.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 14.5 tp -51.33 -54.36 27.03 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 175.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.83 -57.33 9.65 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 114.872 -1.058 . . . . 0.0 109.995 177.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 49.5 ttm -48.09 -51.14 25.74 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.785 0.834 . . . . 0.0 110.755 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 33.6 mt -69.91 -48.49 63.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-O 117.859 -1.067 . . . . 0.0 111.201 -172.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.426 0.0 OUTLIER -87.99 -34.74 17.94 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 115.157 1.54 . . . . 0.0 115.157 -176.593 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 33.4 m120 -80.0 68.6 6.16 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 172.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -33.55 -43.79 0.13 Allowed 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 127.725 2.41 . . . . 0.0 114.364 -174.136 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -40.5 -41.5 1.44 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.572 1.549 . . . . 0.0 113.038 176.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 96.0 mt . . . . . 0 CA--C 1.532 0.281 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -179.085 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.215 0 CA-C-O 120.889 0.376 . . . . 0.0 110.892 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -54.86 161.57 2.25 Favored Pre-proline 0 CA--C 1.542 0.636 0 C-N-CA 124.012 0.925 . . . . 0.0 111.093 173.192 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -48.94 -49.26 15.59 Favored 'Trans proline' 0 N--CA 1.458 -0.592 0 C-N-CA 123.009 2.472 . . . . 0.0 112.424 177.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.6 mt -58.45 -45.54 88.35 Favored 'General case' 0 C--O 1.223 -0.309 0 CA-C-O 118.985 -0.531 . . . . 0.0 111.013 175.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -57.86 -46.09 85.33 Favored 'General case' 0 C--O 1.227 -0.111 0 CA-C-N 118.771 0.714 . . . . 0.0 109.758 -178.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 12.5 tp60 -61.17 -49.07 78.71 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 122.05 0.14 . . . . 0.0 111.052 177.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.12 -46.91 79.06 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 121.503 0.668 . . . . 0.0 111.474 -175.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 76.9 mt -53.74 -53.56 25.53 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.233 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 170.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -45.96 -47.41 14.53 Favored Glycine 0 CA--C 1.528 0.857 0 C-N-CA 124.78 1.181 . . . . 0.0 111.807 175.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.2 mt -55.94 -57.18 13.2 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.22 0.608 . . . . 0.0 110.963 173.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.5 mp -57.44 -43.78 84.17 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.26 0.937 . . . . 0.0 111.899 -178.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 63.6 mt -55.01 -57.93 5.61 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 C-N-CA 123.627 0.771 . . . . 0.0 109.814 172.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -53.72 -49.95 55.93 Favored Glycine 0 CA--C 1.522 0.518 0 N-CA-C 110.411 -1.076 . . . . 0.0 110.411 -176.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 11.7 mm -52.62 -49.59 44.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 C-N-CA 123.581 0.752 . . . . 0.0 110.318 175.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -56.72 -57.42 12.5 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 118.307 0.503 . . . . 0.0 110.147 177.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -59.18 -37.09 76.54 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 123.549 0.74 . . . . 0.0 111.388 -172.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -46.64 -40.84 13.76 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 124.738 1.215 . . . . 0.0 111.41 178.22 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -96.55 -59.44 1.82 Allowed 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 176.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.4 m . . . . . 0 CA--C 1.527 0.082 0 C-N-CA 123.984 0.914 . . . . 0.0 112.273 -171.752 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.2 p . . . . . 0 N--CA 1.451 -0.416 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.34 178.61 9.42 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 125.471 1.509 . . . . 0.0 107.38 168.532 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 7.3 t -134.39 -168.5 2.15 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.462 1.028 . . . . 0.0 113.675 -174.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 21.2 pttt -48.81 -53.3 19.77 Favored 'General case' 0 C--O 1.228 -0.06 0 C-N-CA 126.146 1.778 . . . . 0.0 115.001 -168.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -54.05 -47.69 71.36 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 118.795 0.725 . . . . 0.0 109.961 179.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -63.03 -39.93 96.21 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 123.281 0.632 . . . . 0.0 110.79 178.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.1 mp -61.6 -49.08 78.03 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.901 0.773 . . . . 0.0 112.192 174.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -56.02 -47.79 77.16 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 176.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -54.78 -57.04 13.13 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-O 119.148 -0.453 . . . . 0.0 111.168 173.232 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.6 mt -46.42 -60.49 2.31 Favored 'General case' 0 C--N 1.333 -0.136 0 C-N-CA 123.836 0.854 . . . . 0.0 110.333 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 13.5 tt -62.72 -50.86 78.03 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 C-N-CA 120.44 -0.504 . . . . 0.0 109.879 -176.034 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -59.94 -47.42 85.85 Favored 'General case' 0 CA--C 1.537 0.471 0 O-C-N 121.152 -0.967 . . . . 0.0 112.235 -175.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -76.13 -55.93 5.13 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.819 -0.551 . . . . 0.0 109.707 -177.356 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -84.77 -19.38 32.68 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 -168.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 30.3 mt . . . . . 0 N--CA 1.461 0.096 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 169.328 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.0 t70 . . . . . 0 CA--C 1.521 -0.137 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -36.13 -58.99 0.64 Allowed 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 125.078 1.351 . . . . 0.0 112.581 -179.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 87.7 tt0 -61.4 -39.76 91.89 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.942 0.897 . . . . 0.0 111.388 -176.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -65.2 -54.58 27.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 106.45 -1.685 . . . . 0.0 106.45 -176.552 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 78.5 t -56.76 -42.18 76.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.046 177.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.8 mptp? -55.89 -54.31 46.24 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 119.091 0.86 . . . . 0.0 110.607 175.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 27.5 mt -53.26 -39.3 63.78 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 119.369 -0.348 . . . . 0.0 111.503 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.89 -62.66 1.42 Allowed 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 118.537 0.608 . . . . 0.0 110.078 177.208 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -43.33 -40.14 3.45 Favored 'General case' 0 CA--C 1.523 -0.074 0 C-N-CA 127.062 2.145 . . . . 0.0 111.987 -178.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -39.81 -47.82 2.17 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.303 1.041 . . . . 0.0 112.736 173.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.8 mp -66.49 -34.15 77.28 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 122.898 0.479 . . . . 0.0 110.901 -179.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -74.41 -51.93 13.56 Favored 'General case' 0 N--CA 1.456 -0.128 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 -179.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 17.4 mtp85 . . . . . 0 CA--C 1.531 0.241 0 C-N-CA 123.624 0.77 . . . . 0.0 109.231 170.101 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 . . . . . 0 N--CA 1.45 -0.47 0 N-CA-C 105.11 -2.182 . . . . 0.0 105.11 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 11.6 m -86.34 135.59 24.73 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 -178.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -79.8 171.03 15.67 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 123.731 0.812 . . . . 0.0 111.027 176.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -42.51 -59.52 1.85 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.502 0.721 . . . . 0.0 112.831 176.065 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.2 tp60 -63.85 -33.52 75.87 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 120.9 -1.125 . . . . 0.0 111.113 -175.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -64.81 -41.84 95.47 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 121.385 -0.822 . . . . 0.0 110.779 174.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -55.94 -50.59 70.35 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.414 -0.804 . . . . 0.0 109.38 170.242 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.1 mm -56.66 -37.94 55.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 O-C-N 121.922 -0.486 . . . . 0.0 110.451 176.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 33.2 m -62.63 -39.44 93.85 Favored 'General case' 0 C--O 1.226 -0.137 0 CA-C-N 118.95 0.796 . . . . 0.0 110.013 176.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -55.19 -53.97 49.22 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 173.004 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 53.5 mt -60.91 -45.16 95.74 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 122.04 -0.413 . . . . 0.0 112.017 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.35 -45.34 91.08 Favored Glycine 0 CA--C 1.524 0.616 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 -176.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.51 -45.51 92.66 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 117.691 0.745 . . . . 0.0 110.187 175.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 12.7 tp -51.87 -56.02 16.55 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 118.488 0.585 . . . . 0.0 109.786 174.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.06 -53.32 34.86 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.332 1.053 . . . . 0.0 110.669 178.381 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 44.6 ttm -55.55 -50.76 69.18 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 125.082 1.353 . . . . 0.0 110.757 -179.05 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 62.8 mt -65.92 -53.34 39.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-O 118.454 -0.784 . . . . 0.0 110.265 -175.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.473 0.1 OUTLIER -74.54 -37.55 63.01 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-N 119.739 1.154 . . . . 0.0 113.126 -176.057 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 25.0 m-80 -82.66 61.55 5.82 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 168.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.71 -37.06 3.46 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.88 1.272 . . . . 0.0 112.332 -174.518 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -31.96 -48.36 0.16 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 127.699 2.4 . . . . 0.0 113.306 169.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 46.2 mt . . . . . 0 CA--C 1.529 0.148 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 -177.193 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.227 0 CA-C-O 121.779 0.8 . . . . 0.0 110.746 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 10.5 m -62.76 163.5 15.62 Favored Pre-proline 0 CA--C 1.538 0.484 0 C-N-CA 125.871 1.668 . . . . 0.0 109.206 178.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -48.14 -48.33 16.92 Favored 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 122.921 2.414 . . . . 0.0 113.006 -176.521 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.8 mt -53.73 -52.54 59.81 Favored 'General case' 0 C--O 1.225 -0.192 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 172.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -61.57 -38.74 88.62 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-N 118.063 0.392 . . . . 0.0 110.565 -176.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.2 tp-100 -62.82 -50.9 69.16 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.291 0.636 . . . . 0.0 110.213 176.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.67 -45.93 91.89 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.44 0.638 . . . . 0.0 111.193 -179.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 67.4 mt -53.44 -51.24 43.33 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 170.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -48.59 -47.73 29.38 Favored Glycine 0 CA--C 1.525 0.713 0 C-N-CA 125.359 1.456 . . . . 0.0 111.619 175.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 mt -54.88 -55.21 32.95 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 117.525 0.662 . . . . 0.0 110.651 173.137 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -57.07 -43.6 82.26 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.007 0.822 . . . . 0.0 111.616 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 94.6 mt -56.07 -55.55 17.76 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 C-N-CA 123.487 0.715 . . . . 0.0 110.091 173.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.09 -48.49 73.52 Favored Glycine 0 CA--C 1.523 0.588 0 N-CA-C 110.802 -0.919 . . . . 0.0 110.802 -178.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.5 mm -53.58 -47.53 60.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 C-N-CA 123.183 0.593 . . . . 0.0 110.011 175.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -56.36 -57.37 12.55 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.476 0.58 . . . . 0.0 109.543 175.048 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -52.49 -40.17 62.06 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 125.491 1.516 . . . . 0.0 112.113 -173.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 65.0 tttp -50.96 -34.71 29.98 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.128 1.371 . . . . 0.0 111.467 176.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 71.5 m-85 -101.96 -60.89 1.46 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.615 0.766 . . . . 0.0 110.806 179.103 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 5.0 p . . . . . 0 C--O 1.224 -0.246 0 C-N-CA 123.335 0.654 . . . . 0.0 110.743 -174.528 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 9.5 t-80 . . . . . 0 C--O 1.235 0.313 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 4.8 p -136.58 162.46 33.06 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.898 0.879 . . . . 0.0 112.89 -168.195 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -161.34 174.24 13.81 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.695 1.198 . . . . 0.0 109.255 168.103 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -115.41 171.83 7.47 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.054 0.941 . . . . 0.0 112.832 -169.662 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 14.3 ptmt -35.93 -57.98 0.66 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 127.521 2.328 . . . . 0.0 114.414 179.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.17 -45.43 87.49 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 122.805 0.442 . . . . 0.0 110.118 -178.144 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -62.87 -39.42 94.39 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 123.299 0.64 . . . . 0.0 110.936 177.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 5.9 mt -61.41 -49.82 75.31 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 119.096 0.862 . . . . 0.0 111.849 173.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 89.3 mttt -55.52 -46.84 76.98 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 122.114 -0.366 . . . . 0.0 110.266 176.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -54.62 -55.06 33.4 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 118.856 -0.592 . . . . 0.0 110.915 173.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 8.3 mt -46.38 -61.38 1.82 Allowed 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.295 0.638 . . . . 0.0 110.43 179.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 18.4 tt -59.62 -54.5 33.71 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 119.916 -0.713 . . . . 0.0 110.156 -176.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -60.79 -46.11 91.79 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 118.606 0.639 . . . . 0.0 112.673 -173.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -74.8 -52.75 10.62 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.13 0.572 . . . . 0.0 109.626 -177.474 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 55.4 mm-40 -81.96 -27.52 33.21 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -167.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 41.0 mt . . . . . 0 CA--C 1.523 -0.083 0 N-CA-C 105.114 -2.18 . . . . 0.0 105.114 167.438 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 19.8 t70 . . . . . 0 CA--C 1.529 0.137 0 N-CA-C 115.367 1.617 . . . . 0.0 115.367 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.84 -60.97 0.16 Allowed 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 125.912 1.685 . . . . 0.0 113.35 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -66.15 -39.83 90.11 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 120.792 0.33 . . . . 0.0 110.954 -174.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -61.06 -57.6 11.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 -177.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 52.5 t -57.77 -39.39 70.48 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 CA-C-N 115.01 -0.995 . . . . 0.0 110.187 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -56.17 -52.14 65.45 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 119.794 1.179 . . . . 0.0 111.229 174.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 68.1 mt -55.38 -40.54 71.48 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 119.345 -0.359 . . . . 0.0 111.205 -179.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.47 -60.69 2.1 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 118.839 0.745 . . . . 0.0 110.132 176.366 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -40.46 -46.13 2.37 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 127.369 2.268 . . . . 0.0 111.7 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -39.55 -48.23 2.02 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.449 1.1 . . . . 0.0 112.112 175.423 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 63.2 mt -57.9 -50.83 72.0 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.508 0.723 . . . . 0.0 110.017 -179.232 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -67.21 -41.16 86.23 Favored 'General case' 0 C--O 1.226 -0.15 0 C-N-CA 123.194 0.598 . . . . 0.0 111.067 -178.38 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 53.3 ttm-85 -60.01 -48.21 82.64 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.464 1.106 . . . . 0.0 109.977 -179.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 . . . . . 0 C--O 1.228 -0.051 0 CA-C-O 120.703 0.287 . . . . 0.0 111.316 -177.537 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 44.9 mp0 . . . . . 0 N--CA 1.451 -0.413 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 35.6 m -86.27 154.94 3.38 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 168.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 16.3 p30 -97.93 171.13 8.48 Favored 'General case' 0 CA--C 1.528 0.111 0 C-N-CA 124.797 1.239 . . . . 0.0 111.425 176.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -41.59 -60.98 1.16 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.402 1.081 . . . . 0.0 113.16 175.083 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 41.1 tp60 -63.51 -34.0 76.82 Favored 'General case' 0 C--O 1.225 -0.211 0 O-C-N 121.036 -1.04 . . . . 0.0 110.879 -175.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 54.7 mm-40 -63.01 -45.43 92.4 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 118.932 0.787 . . . . 0.0 111.17 173.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -53.67 -50.03 66.7 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.697 -0.627 . . . . 0.0 109.846 171.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 27.1 mm -58.01 -38.42 66.92 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 O-C-N 121.855 -0.528 . . . . 0.0 110.652 176.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 70.7 m -63.11 -41.71 99.4 Favored 'General case' 0 C--O 1.226 -0.174 0 O-C-N 121.506 -0.746 . . . . 0.0 109.972 176.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -56.37 -54.28 47.48 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 174.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 42.2 mt -58.82 -47.65 84.04 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 121.975 -0.453 . . . . 0.0 112.032 178.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.75 -43.94 97.02 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 110.87 -0.892 . . . . 0.0 110.87 -176.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.07 -48.26 79.42 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 121.988 -0.713 . . . . 0.0 110.205 176.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -49.56 -56.83 8.53 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-O 121.864 0.84 . . . . 0.0 109.88 173.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.94 -54.54 23.37 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 114.612 -1.176 . . . . 0.0 110.376 179.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 19.7 ttp -62.4 -45.57 92.52 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 123.596 0.758 . . . . 0.0 111.648 -177.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 75.4 mt -60.66 -47.88 91.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.012 -177.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.484 0.0 OUTLIER -82.45 -34.16 28.25 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 114.476 1.287 . . . . 0.0 114.476 -179.926 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -80.6 75.05 7.5 Favored 'General case' 0 N--CA 1.462 0.159 0 O-C-N 120.779 -1.201 . . . . 0.0 108.505 171.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -40.41 -37.99 0.76 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.834 1.654 . . . . 0.0 112.977 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -39.93 -42.3 1.32 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.527 1.531 . . . . 0.0 113.46 173.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 93.9 mt . . . . . 0 CA--C 1.533 0.319 0 C-N-CA 123.763 0.825 . . . . 0.0 113.029 -176.956 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.237 0 CA-C-O 121.222 0.534 . . . . 0.0 111.972 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -50.32 158.33 1.03 Allowed Pre-proline 0 CA--C 1.54 0.586 0 C-N-CA 124.702 1.201 . . . . 0.0 111.541 177.314 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_exo -44.67 -49.89 8.89 Favored 'Trans proline' 0 N--CA 1.46 -0.491 0 C-N-CA 123.501 2.801 . . . . 0.0 113.404 -179.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.2 mt -55.9 -48.96 74.71 Favored 'General case' 0 C--O 1.226 -0.164 0 O-C-N 122.427 -0.17 . . . . 0.0 111.316 174.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -59.77 -46.9 87.75 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -177.376 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 12.2 tp60 -59.92 -47.27 86.47 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 122.505 0.322 . . . . 0.0 110.736 177.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.59 -46.04 77.25 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.091 0.472 . . . . 0.0 111.412 -176.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 77.9 mt -54.2 -50.66 54.06 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 170.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.46 -48.14 22.14 Favored Glycine 0 CA--C 1.528 0.89 0 C-N-CA 124.966 1.27 . . . . 0.0 111.893 174.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.9 mt -55.52 -56.8 16.02 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 117.71 0.755 . . . . 0.0 110.553 174.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.6 mp -57.98 -43.46 86.56 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 119.018 0.826 . . . . 0.0 111.752 -178.108 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 73.5 mt -55.48 -56.53 11.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 C-N-CA 124.03 0.932 . . . . 0.0 110.356 173.255 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.58 -49.33 65.74 Favored Glycine 0 CA--C 1.523 0.542 0 N-CA-C 110.544 -1.022 . . . . 0.0 110.544 -177.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 8.7 mm -54.03 -48.44 64.39 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 C-N-CA 123.674 0.79 . . . . 0.0 110.148 176.099 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -54.98 -61.4 2.33 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 118.45 0.568 . . . . 0.0 109.525 176.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -53.42 -39.32 64.27 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.583 0.753 . . . . 0.0 111.633 -174.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -50.64 -36.77 37.01 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.842 0.857 . . . . 0.0 111.734 178.161 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -101.12 -53.37 3.04 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.306 0.642 . . . . 0.0 110.028 -178.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 CA--C 1.529 0.144 0 O-C-N 121.322 -0.861 . . . . 0.0 111.907 179.993 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 48.0 p . . . . . 0 N--CA 1.453 -0.314 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -154.79 159.04 40.35 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 122.631 0.372 . . . . 0.0 111.463 169.617 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 81.0 p -103.38 167.12 10.01 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.782 0.833 . . . . 0.0 112.936 -169.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.0 pttm -32.98 -48.69 0.21 Allowed 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 127.158 2.183 . . . . 0.0 113.987 170.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.5 tmmm? -60.1 -52.23 66.25 Favored 'General case' 0 N--CA 1.453 -0.311 0 O-C-N 121.969 -0.457 . . . . 0.0 109.9 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -61.08 -36.35 79.41 Favored 'General case' 0 C--O 1.223 -0.311 0 CA-C-O 119.346 -0.359 . . . . 0.0 110.776 178.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 48.6 mt -67.99 -49.9 58.86 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.575 0.625 . . . . 0.0 111.659 179.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp -60.46 -39.71 88.56 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 121.912 -0.493 . . . . 0.0 109.972 176.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -56.88 -63.96 1.03 Allowed 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 169.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.7 mt -39.49 -58.64 1.23 Allowed 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 125.212 1.405 . . . . 0.0 112.266 -178.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 16.0 tt -58.61 -51.37 72.63 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 -177.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -59.26 -42.01 90.15 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 120.995 -1.065 . . . . 0.0 112.718 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.1 mmpt? -77.7 -49.53 14.27 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 125.256 1.423 . . . . 0.0 110.694 -170.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -102.77 -24.05 13.75 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.914 1.286 . . . . 0.0 112.709 -168.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 69.5 mt . . . . . 0 CA--C 1.527 0.064 0 N-CA-C 107.384 -1.339 . . . . 0.0 107.384 169.025 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 . . . . . 0 N--CA 1.462 0.173 0 N-CA-C 113.808 1.04 . . . . 0.0 113.808 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.27 -54.89 0.14 Allowed 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.948 1.699 . . . . 0.0 113.357 177.038 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 74.4 tt0 -67.29 -42.98 82.86 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.482 0.658 . . . . 0.0 111.031 -175.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 1.1 mp -62.22 -50.6 79.33 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 N-CA-C 106.565 -1.643 . . . . 0.0 106.565 -178.242 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 77.1 t -54.09 -56.25 10.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 N-CA-C 109.09 -0.708 . . . . 0.0 109.09 176.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.9 mptt -45.23 -52.54 9.38 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 123.235 0.614 . . . . 0.0 112.317 -179.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 15.3 mt -50.07 -42.31 49.68 Favored 'General case' 0 CA--C 1.535 0.378 0 O-C-N 123.194 0.309 . . . . 0.0 111.815 -179.068 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 1.2 mpp? -81.39 -66.15 0.92 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.694 0.798 . . . . 0.0 109.642 179.149 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -40.29 -37.73 0.69 Allowed 'General case' 0 N--CA 1.461 0.093 0 C-N-CA 127.503 2.321 . . . . 0.0 112.789 -178.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -38.45 -53.37 1.55 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.939 0.896 . . . . 0.0 112.124 172.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -60.51 -37.1 80.04 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 110.564 -0.162 . . . . 0.0 110.564 -175.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -73.82 -51.53 16.03 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.624 0.77 . . . . 0.0 109.83 -177.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.534 0.35 0 CA-C-O 120.435 0.159 . . . . 0.0 111.001 -177.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 51.6 mp0 . . . . . 0 N--CA 1.451 -0.383 0 N-CA-C 105.429 -2.063 . . . . 0.0 105.429 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.0 m -79.05 138.03 20.78 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 -169.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -79.82 171.89 14.51 Favored 'General case' 0 C--O 1.231 0.113 0 C-N-CA 122.685 0.394 . . . . 0.0 110.577 176.465 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -43.95 -56.93 3.61 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.623 0.769 . . . . 0.0 112.673 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 34.8 tp60 -63.73 -33.71 76.25 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 120.968 -1.083 . . . . 0.0 110.789 -176.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -66.62 -42.01 87.48 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 118.761 0.709 . . . . 0.0 110.641 176.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -54.69 -48.59 72.25 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 121.653 -0.654 . . . . 0.0 109.813 169.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.449 ' CG2' ' CG2' ' B' ' 74' ' ' ILE . 24.4 mm -62.51 -29.75 47.56 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 O-C-N 121.828 -0.545 . . . . 0.0 111.275 175.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 39.1 m -68.23 -43.7 77.35 Favored 'General case' 0 C--O 1.225 -0.205 0 O-C-N 120.922 -1.112 . . . . 0.0 109.496 173.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 58.1 t80 -56.28 -58.06 9.6 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 175.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 71.1 mt -61.3 -44.48 97.15 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 122.101 -0.374 . . . . 0.0 111.79 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.78 -44.03 95.37 Favored Glycine 0 CA--C 1.527 0.811 0 N-CA-C 111.071 -0.812 . . . . 0.0 111.071 -176.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.12 -47.92 75.46 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 117.798 0.799 . . . . 0.0 109.938 176.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 37.6 tp -47.11 -57.31 5.23 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 121.786 0.803 . . . . 0.0 110.226 172.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -53.38 -49.51 67.06 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 114.633 -1.167 . . . . 0.0 110.904 177.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 44.9 ttm -57.68 -51.23 70.37 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.171 0.988 . . . . 0.0 110.689 -179.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 65.4 mt -61.32 -50.71 79.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-O 118.287 -0.863 . . . . 0.0 109.577 -176.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.431 1.7 p90 -72.89 -40.79 65.3 Favored 'General case' 0 C--N 1.347 0.469 0 C-N-CA 118.818 -1.153 . . . . 0.0 113.301 -177.464 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 43.7 m-80 -78.81 74.85 5.33 Favored 'General case' 0 N--CA 1.462 0.135 0 O-C-N 121.077 -1.015 . . . . 0.0 108.634 172.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -39.56 -41.55 1.03 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.525 1.53 . . . . 0.0 113.074 -179.187 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -38.37 -46.41 1.12 Allowed 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.349 1.46 . . . . 0.0 112.885 173.114 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.0 mt . . . . . 0 CA--C 1.534 0.348 0 C-N-CA 124.315 1.046 . . . . 0.0 113.367 -175.715 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.249 0 CA-C-O 120.739 0.304 . . . . 0.0 110.633 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 2.9 m -52.83 159.41 1.81 Allowed Pre-proline 0 CA--C 1.542 0.655 0 C-N-CA 123.56 0.744 . . . . 0.0 110.976 171.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -49.02 -50.08 13.66 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 123.067 2.512 . . . . 0.0 113.099 -177.255 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.3 mt -55.56 -45.07 77.33 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 173.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -64.21 -38.57 91.52 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 118.35 0.523 . . . . 0.0 109.868 -176.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 14.2 tp60 -64.43 -46.75 81.87 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.542 0.337 . . . . 0.0 110.838 174.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.39 -47.87 80.24 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.539 0.685 . . . . 0.0 110.989 -178.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 74.6 mt -53.35 -51.95 36.19 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 169.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.66 -43.48 21.99 Favored Glycine 0 CA--C 1.526 0.773 0 C-N-CA 125.717 1.627 . . . . 0.0 112.109 175.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 mt -59.38 -54.15 50.04 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 117.704 0.752 . . . . 0.0 110.598 173.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.7 mp -58.23 -43.66 87.85 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 118.814 0.734 . . . . 0.0 111.341 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 76.3 mt -56.03 -55.93 15.63 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.157 0 C-N-CA 123.825 0.85 . . . . 0.0 109.921 173.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -53.97 -50.61 54.22 Favored Glycine 0 CA--C 1.521 0.445 0 N-CA-C 110.023 -1.231 . . . . 0.0 110.023 -177.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 8.6 mm -53.0 -48.88 51.55 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 C-N-CA 123.508 0.723 . . . . 0.0 110.586 175.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -57.24 -60.99 2.79 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.949 0.404 . . . . 0.0 109.953 177.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -52.07 -40.63 61.48 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 125.418 1.487 . . . . 0.0 111.564 -174.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -46.36 -34.6 4.72 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.538 1.535 . . . . 0.0 111.623 179.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 85.4 m-85 -110.71 -50.15 2.98 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 122.817 0.447 . . . . 0.0 110.786 177.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 12.4 p . . . . . 0 C--O 1.227 -0.104 0 C-N-CA 123.427 0.691 . . . . 0.0 111.126 -174.56 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 17.7 p-80 . . . . . 0 CA--C 1.536 0.412 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 32.6 p -132.49 164.41 26.64 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 123.947 0.899 . . . . 0.0 109.739 176.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -160.21 167.21 28.12 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.771 0.428 . . . . 0.0 110.936 169.736 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 46.7 m -113.71 170.09 8.5 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.923 1.289 . . . . 0.0 113.449 -169.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -32.2 -52.23 0.27 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 128.299 2.64 . . . . 0.0 115.265 178.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -59.03 -59.29 5.7 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -178.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -52.48 -39.88 61.69 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 123.521 0.728 . . . . 0.0 111.37 177.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 54.3 mt -65.05 -51.31 62.25 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 118.8 0.727 . . . . 0.0 112.079 179.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 8.2 mtmp? -61.77 -45.3 94.48 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 121.662 -0.649 . . . . 0.0 109.908 178.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -49.93 -56.91 8.74 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.45 0.7 . . . . 0.0 110.512 169.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 4.1 mt -45.5 -61.79 1.54 Allowed 'General case' 0 CA--C 1.521 -0.173 0 C-N-CA 124.351 1.06 . . . . 0.0 110.416 177.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 2.8 tp -60.55 -49.25 85.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 -173.376 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 -55.17 -48.55 73.62 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.302 1.041 . . . . 0.0 111.838 -178.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 8.5 mtmp? -76.66 -53.11 8.45 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 120.914 0.388 . . . . 0.0 111.264 -176.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -78.89 -26.47 43.86 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -167.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 49.9 mt . . . . . 0 N--CA 1.456 -0.132 0 N-CA-C 106.438 -1.69 . . . . 0.0 106.438 167.632 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 . . . . . 0 C--O 1.225 -0.235 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.84 -59.69 0.17 Allowed 'General case' 0 CA--C 1.527 0.096 0 C-N-CA 125.882 1.673 . . . . 0.0 113.732 178.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 74.1 tt0 -65.86 -38.44 88.83 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.742 0.306 . . . . 0.0 110.695 -173.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.1 mp -63.5 -53.43 45.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 N-CA-C 106.893 -1.521 . . . . 0.0 106.893 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 78.8 t -56.02 -44.36 78.19 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 C-N-CA 124.226 1.011 . . . . 0.0 110.04 179.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -56.1 -53.91 51.38 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 118.779 0.718 . . . . 0.0 110.759 173.117 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 66.6 mt -53.56 -41.29 66.33 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 119.082 -0.485 . . . . 0.0 111.374 178.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 25.9 mmt -67.57 -61.36 1.93 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.896 0.771 . . . . 0.0 109.646 176.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -42.8 -43.88 4.19 Favored 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 127.441 2.296 . . . . 0.0 111.437 -177.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -39.64 -48.66 2.14 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.397 1.079 . . . . 0.0 112.302 176.115 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 10.2 mp -63.02 -48.59 78.11 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 -176.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -62.83 -45.32 93.17 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 122.825 0.45 . . . . 0.0 110.606 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 45.4 ttm-85 -55.73 -51.95 65.59 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 123.6 0.76 . . . . 0.0 109.198 176.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 . . . . . 0 CA--C 1.53 0.203 0 C-N-CA 123.079 0.552 . . . . 0.0 110.586 -176.675 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 . . . . . 0 N--CA 1.453 -0.29 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 5.6 m -78.98 140.93 16.1 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 174.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 18.6 p30 -82.89 172.82 12.41 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 123.556 0.742 . . . . 0.0 110.902 175.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -44.34 -60.18 2.05 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.001 0.92 . . . . 0.0 112.56 176.049 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 50.4 tp60 -62.72 -35.51 79.98 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 119.381 0.991 . . . . 0.0 110.925 -175.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 57.9 mm-40 -60.82 -47.75 84.91 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 119.032 0.833 . . . . 0.0 111.094 173.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -53.25 -49.22 67.32 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 122.004 -0.435 . . . . 0.0 110.145 172.549 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.449 ' CG2' ' CG2' ' A' ' 74' ' ' ILE . 29.8 mm -57.83 -39.21 69.94 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 O-C-N 121.735 -0.603 . . . . 0.0 110.66 176.239 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 57.8 m -63.87 -41.09 97.83 Favored 'General case' 0 C--O 1.227 -0.125 0 O-C-N 121.587 -0.695 . . . . 0.0 110.106 177.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 32.0 t80 -54.32 -53.16 57.64 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 173.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 75.9 mt -62.4 -42.28 99.31 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 178.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.32 -42.39 94.07 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 110.718 -0.953 . . . . 0.0 110.718 -177.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.6 -46.76 88.45 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 123.41 0.684 . . . . 0.0 109.886 174.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 10.2 tp -51.51 -54.59 25.63 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 174.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -53.08 -52.5 58.38 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.899 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 28.8 mtt -50.7 -55.69 15.4 Favored 'General case' 0 CA--C 1.526 0.049 0 C-N-CA 123.825 0.85 . . . . 0.0 111.347 174.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 49.0 mt -63.12 -47.37 92.8 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.327 0 CA-C-O 118.105 -0.95 . . . . 0.0 110.433 -169.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.475 0.0 OUTLIER -83.48 -39.69 20.18 Favored 'General case' 0 C--N 1.347 0.463 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 179.818 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 16.4 m-80 -82.37 65.98 7.75 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 107.294 -1.373 . . . . 0.0 107.294 169.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -43.96 -37.86 3.15 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.543 1.137 . . . . 0.0 112.701 -174.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.27 -48.46 0.23 Allowed 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 127.024 2.13 . . . . 0.0 113.346 169.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 97.3 mt . . . . . 0 CA--C 1.528 0.104 0 N-CA-C 112.573 0.583 . . . . 0.0 112.573 -176.356 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.259 0 CA-C-O 120.506 0.193 . . . . 0.0 111.317 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.4 m -52.67 157.91 2.39 Favored Pre-proline 0 CA--C 1.534 0.353 0 C-N-CA 123.991 0.916 . . . . 0.0 110.266 172.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_exo -40.09 -52.03 2.98 Favored 'Trans proline' 0 N--CA 1.459 -0.511 0 C-N-CA 124.038 3.158 . . . . 0.0 113.82 -179.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.6 mt -54.05 -60.41 3.36 Favored 'General case' 0 C--O 1.225 -0.207 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 173.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -55.77 -40.11 72.14 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-O 121.004 0.43 . . . . 0.0 110.708 -175.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -64.96 -51.63 60.72 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.356 1.062 . . . . 0.0 110.144 -179.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.05 -46.77 87.4 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.221 1.008 . . . . 0.0 110.901 178.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 69.1 mt -51.94 -55.07 10.83 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 170.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.23 -47.88 20.95 Favored Glycine 0 CA--C 1.527 0.834 0 C-N-CA 125.148 1.356 . . . . 0.0 112.033 176.372 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.9 mt -55.0 -53.43 55.85 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.612 0.765 . . . . 0.0 110.986 174.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -59.33 -45.0 92.54 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 121.582 -0.699 . . . . 0.0 111.792 179.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 83.9 mt -55.72 -55.6 16.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 C-N-CA 123.714 0.806 . . . . 0.0 109.819 175.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -52.74 -51.97 41.32 Favored Glycine 0 CA--C 1.521 0.447 0 N-CA-C 109.724 -1.35 . . . . 0.0 109.724 -177.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 3.2 mm -56.71 -47.31 82.7 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 CA-C-O 119.332 -0.366 . . . . 0.0 110.634 179.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -53.03 -60.44 3.29 Favored 'General case' 0 C--N 1.339 0.14 0 CA-C-N 118.126 0.421 . . . . 0.0 110.055 175.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -60.55 -34.69 74.52 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 118.987 -0.53 . . . . 0.0 111.19 -171.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.3 ttpp -52.72 -37.9 59.92 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.134 0.574 . . . . 0.0 111.442 -179.258 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -97.27 -58.48 2.0 Favored 'General case' 0 C--O 1.227 -0.116 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 175.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.8 t . . . . . 0 CA--C 1.533 0.303 0 C-N-CA 124.369 1.068 . . . . 0.0 111.733 -173.727 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 31.6 p . . . . . 0 N--CA 1.446 -0.63 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -158.43 177.55 11.13 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.816 1.247 . . . . 0.0 108.059 174.028 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 8.5 t -139.13 -169.46 2.66 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 119.861 1.209 . . . . 0.0 112.282 -175.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 41.9 pttt -41.44 -54.07 3.2 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 127.279 2.231 . . . . 0.0 113.61 -169.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -53.62 -51.94 61.47 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.064 0.546 . . . . 0.0 110.267 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 14.6 mp0 -64.92 -41.87 95.19 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 -178.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 41.8 mt -62.07 -47.38 84.91 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 118.544 0.611 . . . . 0.0 111.528 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -61.51 -49.94 74.72 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 176.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 78.3 tt0 -48.82 -54.89 13.32 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.168 0.987 . . . . 0.0 110.574 175.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.5 mt -48.41 -75.26 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 126.007 1.723 . . . . 0.0 109.022 174.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 15.6 tt -55.26 -47.05 78.16 Favored 'Isoleucine or valine' 0 C--N 1.341 0.235 0 CA-C-N 118.427 0.558 . . . . 0.0 111.268 -169.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.3 tt0 -52.23 -47.79 65.5 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 123.64 0.776 . . . . 0.0 111.37 -177.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 73.1 mttt -81.01 -62.58 1.62 Allowed 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 121.733 0.778 . . . . 0.0 109.506 -179.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -55.87 -36.33 67.47 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 114.842 -1.072 . . . . 0.0 111.882 -169.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 85.1 mt . . . . . 0 N--CA 1.452 -0.369 0 C-N-CA 124.842 1.257 . . . . 0.0 107.743 171.155 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 . . . . . 0 CA--C 1.528 0.11 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.84 -60.39 0.16 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.804 1.642 . . . . 0.0 114.1 -174.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -65.29 -42.68 92.89 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 122.958 0.503 . . . . 0.0 111.137 -175.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 1.2 mp -60.01 -53.01 54.5 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 N-CA-C 106.876 -1.528 . . . . 0.0 106.876 -178.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 72.1 t -54.13 -55.35 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 CA-C-N 115.523 -0.762 . . . . 0.0 108.976 178.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -47.26 -54.48 10.78 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 118.489 0.586 . . . . 0.0 111.724 178.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 25.8 mt -51.55 -41.11 60.87 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 -177.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -80.79 -65.26 1.03 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.343 0.657 . . . . 0.0 110.37 178.698 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -37.91 -42.43 0.62 Allowed 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 127.38 2.272 . . . . 0.0 112.139 179.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -38.22 -49.27 1.36 Allowed 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 124.671 1.188 . . . . 0.0 112.546 175.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.8 pp -58.73 -41.68 87.02 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.459 0.572 . . . . 0.0 111.148 -175.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -75.66 -46.28 32.3 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 123.661 0.784 . . . . 0.0 109.967 -178.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 59.7 ttm-85 . . . . . 0 CA--C 1.529 0.159 0 C-N-CA 123.831 0.852 . . . . 0.0 110.291 176.495 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 . . . . . 0 N--CA 1.454 -0.245 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.6 m -79.65 145.63 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 172.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.9 p-10 -88.54 177.88 6.67 Favored 'General case' 0 C--O 1.231 0.086 0 C-N-CA 122.832 0.453 . . . . 0.0 110.825 175.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -42.6 -59.73 1.8 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.684 0.794 . . . . 0.0 112.241 172.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 61.6 tp60 -60.75 -37.0 80.34 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 119.294 0.952 . . . . 0.0 111.683 -175.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -67.97 -37.43 81.52 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.248 -0.908 . . . . 0.0 111.217 176.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -58.0 -48.43 80.04 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.12 -0.988 . . . . 0.0 109.474 169.344 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 30.6 mm -58.76 -32.8 47.53 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 123.171 0.589 . . . . 0.0 110.497 175.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 56.0 m -69.86 -38.96 76.6 Favored 'General case' 0 C--O 1.225 -0.216 0 O-C-N 121.504 -0.747 . . . . 0.0 110.621 174.052 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -59.16 -55.73 31.28 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.56 0.618 . . . . 0.0 109.366 174.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 32.1 mt -56.8 -46.61 81.46 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 120.711 0.291 . . . . 0.0 110.931 175.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -58.18 -44.3 94.93 Favored Glycine 0 CA--C 1.525 0.673 0 C-N-CA 124.346 0.974 . . . . 0.0 111.448 -178.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.58 -47.43 69.75 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.45 0.7 . . . . 0.0 109.899 178.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -49.98 -54.3 20.86 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.446 0.641 . . . . 0.0 109.565 173.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -53.15 -55.57 23.07 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 124.702 1.201 . . . . 0.0 110.968 177.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 40.2 ttm -52.33 -52.12 54.96 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 124.775 1.23 . . . . 0.0 110.524 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 56.6 mt -62.81 -51.68 68.95 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-O 118.088 -0.958 . . . . 0.0 109.706 -172.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.427 0.0 OUTLIER -81.51 -32.31 32.42 Favored 'General case' 0 C--N 1.346 0.436 0 N-CA-C 114.667 1.358 . . . . 0.0 114.667 -176.392 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -80.36 76.48 7.17 Favored 'General case' 0 CA--C 1.521 -0.157 0 O-C-N 120.714 -1.242 . . . . 0.0 108.615 175.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -35.07 -49.83 0.48 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.522 1.529 . . . . 0.0 111.689 177.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -38.33 -43.78 0.84 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 126.893 2.077 . . . . 0.0 114.088 177.007 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 55.2 mt . . . . . 0 N--CA 1.456 -0.158 0 CA-C-O 119.432 -0.318 . . . . 0.0 111.339 -178.47 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.241 0 CA-C-O 121.137 0.494 . . . . 0.0 110.581 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 4.5 t -45.71 150.43 0.95 Allowed Pre-proline 0 CA--C 1.535 0.393 0 C-N-CA 124.292 1.037 . . . . 0.0 110.521 169.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo -43.56 -42.73 11.19 Favored 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 123.083 2.522 . . . . 0.0 112.097 168.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.0 mt -66.57 -43.06 86.0 Favored 'General case' 0 C--O 1.223 -0.331 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 174.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -57.07 -46.47 82.48 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 119.015 0.825 . . . . 0.0 109.407 177.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 -58.99 -52.73 64.49 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.57 0.748 . . . . 0.0 110.805 175.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.14 -46.76 85.73 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.301 0.64 . . . . 0.0 112.063 -175.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 73.9 mt -54.5 -53.21 32.95 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 N-CA-C 107.886 -1.154 . . . . 0.0 107.886 170.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.25 -46.27 15.99 Favored Glycine 0 CA--C 1.528 0.846 0 C-N-CA 124.64 1.114 . . . . 0.0 112.067 175.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 mt -58.23 -57.37 13.18 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.918 0.887 . . . . 0.0 110.918 174.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.07 -43.74 87.14 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.264 0.938 . . . . 0.0 111.669 -178.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 59.3 mt -56.35 -55.35 19.44 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.156 0 C-N-CA 123.623 0.769 . . . . 0.0 110.0 173.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.89 -49.15 63.28 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 110.566 -1.014 . . . . 0.0 110.566 -177.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 11.2 mm -53.06 -49.37 50.28 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 C-N-CA 123.454 0.701 . . . . 0.0 109.871 175.05 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 37.7 t80 -56.8 -52.43 65.07 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 121.805 -0.559 . . . . 0.0 110.768 176.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -58.57 -38.3 77.58 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 124.687 1.195 . . . . 0.0 111.106 -174.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 61.8 tttm -57.76 -25.82 60.99 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.933 1.293 . . . . 0.0 112.497 -179.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 56.2 m-85 -117.1 -62.22 1.61 Allowed 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.372 0.669 . . . . 0.0 109.903 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.332 -0.191 0 C-N-CA 124.164 0.985 . . . . 0.0 110.162 -176.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 12.9 t-80 . . . . . 0 CA--C 1.534 0.336 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -138.54 158.75 43.66 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 125.195 1.398 . . . . 0.0 111.316 -169.052 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.47 176.11 12.0 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 125.388 1.475 . . . . 0.0 108.212 171.397 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 7.3 t -135.59 -166.27 1.82 Allowed 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.731 1.151 . . . . 0.0 113.304 177.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -38.67 -65.12 0.38 Allowed 'General case' 0 N--CA 1.458 -0.064 0 C-N-CA 128.19 2.596 . . . . 0.0 113.175 -169.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 36.3 ttpt -51.96 -50.3 61.49 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 123.465 0.706 . . . . 0.0 110.238 -175.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -61.36 -43.97 97.97 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 123.25 0.62 . . . . 0.0 110.15 -177.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 34.7 mt -62.4 -50.89 69.73 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 118.187 0.449 . . . . 0.0 111.546 177.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -61.93 -42.3 98.94 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 -178.211 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -56.42 -65.33 0.62 Allowed 'General case' 0 C--O 1.22 -0.476 0 CA-C-O 118.515 -0.755 . . . . 0.0 109.13 169.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 5.5 mt -35.04 -62.98 0.35 Allowed 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 125.321 1.449 . . . . 0.0 111.687 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 15.9 tt -60.49 -50.78 79.0 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 C-N-CA 120.297 -0.561 . . . . 0.0 110.306 -175.074 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 16.0 tt0 -62.11 -41.07 97.86 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.317 0.508 . . . . 0.0 112.151 -176.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 6.2 mmpt? -69.85 -54.13 14.92 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.637 1.175 . . . . 0.0 109.473 -177.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 -83.43 -35.54 24.92 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.58 -0.736 . . . . 0.0 112.682 -167.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 47.1 mt . . . . . 0 C--N 1.339 0.14 0 CA-C-N 119.36 0.982 . . . . 0.0 108.809 170.834 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 . . . . . 0 CA--C 1.53 0.2 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.35 -58.15 0.15 Allowed 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 126.541 1.936 . . . . 0.0 113.972 -178.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 65.0 tt0 -68.34 -40.41 81.57 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 121.066 0.46 . . . . 0.0 110.878 -172.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.9 mp -62.99 -52.5 58.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 N-CA-C 106.865 -1.531 . . . . 0.0 106.865 179.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 72.0 t -54.85 -46.63 75.49 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 C-N-CA 124.362 1.065 . . . . 0.0 109.829 178.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.42 -53.61 54.07 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 119.402 1.001 . . . . 0.0 110.565 175.404 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 39.9 mt -53.22 -41.47 65.38 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 118.972 -0.537 . . . . 0.0 111.494 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 27.8 mmt -70.21 -65.14 0.76 Allowed 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 118.716 0.689 . . . . 0.0 109.643 175.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -43.71 -35.02 1.67 Allowed 'General case' 0 CA--C 1.518 -0.282 0 C-N-CA 128.356 2.662 . . . . 0.0 112.192 -174.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -37.85 -49.97 1.24 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.0 0.92 . . . . 0.0 111.87 173.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.9 pp -61.34 -43.48 98.79 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.366 0.53 . . . . 0.0 111.331 -177.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -69.6 -41.11 76.19 Favored 'General case' 0 C--O 1.226 -0.183 0 C-N-CA 123.941 0.896 . . . . 0.0 110.113 -177.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 14.2 ttm180 -62.73 -48.5 78.96 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 124.76 1.224 . . . . 0.0 110.033 179.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 . . . . . 0 C--O 1.226 -0.143 0 CA-C-N 116.713 -0.221 . . . . 0.0 111.248 -175.401 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 16.3 mp0 . . . . . 0 N--CA 1.451 -0.413 0 CA-C-O 120.459 0.171 . . . . 0.0 110.839 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 25.2 m -101.56 151.22 5.65 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 N-CA-C 106.698 -1.593 . . . . 0.0 106.698 167.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 10.2 p30 -94.67 171.86 8.53 Favored 'General case' 0 C--O 1.231 0.129 0 C-N-CA 123.404 0.682 . . . . 0.0 110.624 176.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -35.5 -59.87 0.53 Allowed 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.351 1.461 . . . . 0.0 113.486 177.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -66.53 -31.77 72.71 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 120.429 1.468 . . . . 0.0 111.616 -174.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.34 -36.44 68.81 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 121.271 -0.893 . . . . 0.0 109.822 177.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -56.29 -53.77 53.29 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 168.4 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 19.9 mm -53.74 -42.0 49.96 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.406 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 177.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 70.4 m -63.06 -27.21 69.24 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 119.018 0.827 . . . . 0.0 111.831 177.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 10.7 t80 -58.35 -52.84 63.92 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.459 1.027 . . . . 0.0 108.321 170.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 48.8 mt -64.61 -41.31 96.29 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.861 0.865 . . . . 0.0 111.668 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -70.78 -42.27 61.77 Favored Glycine 0 CA--C 1.526 0.749 0 C-N-CA 124.408 1.004 . . . . 0.0 110.658 -175.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.21 -43.91 76.96 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 121.924 -0.75 . . . . 0.0 110.079 175.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 12.1 tp -49.61 -56.8 8.71 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 121.281 0.563 . . . . 0.0 109.774 171.159 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.15 -53.67 25.99 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 124.391 1.076 . . . . 0.0 110.32 178.188 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 53.7 ttm -54.45 -50.07 68.55 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.937 0.895 . . . . 0.0 111.129 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 98.1 mt -63.95 -55.01 24.63 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 CA-C-O 118.48 -0.772 . . . . 0.0 110.578 -176.154 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.45 0.1 OUTLIER -76.69 -35.2 58.04 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.419 1.009 . . . . 0.0 113.284 -175.029 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 26.0 m-80 -82.55 72.79 9.61 Favored 'General case' 0 N--CA 1.465 0.284 0 O-C-N 120.63 -1.294 . . . . 0.0 107.97 169.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -46.89 -31.48 3.14 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.968 0.907 . . . . 0.0 113.051 -176.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -42.15 -41.88 2.81 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.879 1.272 . . . . 0.0 113.106 172.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 84.2 mt . . . . . 0 CA--C 1.531 0.226 0 C-N-CA 123.161 0.584 . . . . 0.0 112.424 -179.3 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.228 0 CA-C-O 120.868 0.366 . . . . 0.0 110.523 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.59 165.84 2.07 Favored Pre-proline 0 CA--C 1.538 0.493 0 C-N-CA 124.282 1.033 . . . . 0.0 111.143 176.922 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_exo -46.26 -47.98 13.99 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 123.367 2.711 . . . . 0.0 113.054 178.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.1 mt -56.95 -49.84 74.46 Favored 'General case' 0 C--N 1.34 0.168 0 CA-C-O 119.472 -0.299 . . . . 0.0 111.428 175.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -58.97 -45.04 91.52 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-N 118.248 0.476 . . . . 0.0 109.857 -178.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -59.43 -49.99 75.67 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 122.9 0.48 . . . . 0.0 110.239 178.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.69 -45.87 84.8 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.416 0.687 . . . . 0.0 111.666 -177.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 71.5 mt -54.72 -50.94 56.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 171.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.74 -49.44 22.09 Favored Glycine 0 CA--C 1.526 0.771 0 C-N-CA 125.012 1.291 . . . . 0.0 111.527 174.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.3 mt -54.79 -56.67 16.89 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 117.576 0.688 . . . . 0.0 110.889 173.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -57.28 -42.59 81.93 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 119.203 0.91 . . . . 0.0 111.72 -178.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 95.6 mt -59.81 -54.11 39.11 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 123.518 0.727 . . . . 0.0 110.908 174.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.4 -50.59 61.63 Favored Glycine 0 CA--C 1.522 0.511 0 N-CA-C 109.883 -1.287 . . . . 0.0 109.883 -177.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 9.9 mm -50.87 -51.76 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 C-N-CA 123.92 0.888 . . . . 0.0 109.968 173.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -52.24 -61.57 2.19 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 178.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 6.0 m-70 -65.33 -23.87 67.11 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 113.958 1.096 . . . . 0.0 113.958 -172.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 62.4 tttm -50.24 -31.94 15.35 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 118.766 0.712 . . . . 0.0 111.147 169.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -113.0 -33.54 6.01 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.482 0.713 . . . . 0.0 112.683 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 77.4 p . . . . . 0 N--CA 1.464 0.25 0 CA-C-N 119.891 1.223 . . . . 0.0 113.204 -178.803 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 46.0 p . . . . . 0 N--CA 1.456 -0.173 0 CA-C-O 120.849 0.357 . . . . 0.0 111.452 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -161.16 -177.19 5.9 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.377 1.471 . . . . 0.0 107.616 168.57 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.4 p -139.25 176.84 8.37 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 119.59 1.086 . . . . 0.0 112.805 -173.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 19.8 pttt -30.84 -53.78 0.19 Allowed 'General case' 0 N--CA 1.457 -0.099 0 C-N-CA 127.646 2.378 . . . . 0.0 114.874 179.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 24.8 ttpp -58.07 -49.12 78.03 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 118.888 0.767 . . . . 0.0 110.743 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.4 mp0 -64.07 -36.02 82.63 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 122.685 0.394 . . . . 0.0 110.619 178.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 45.2 mt -68.07 -47.6 67.85 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.617 0.644 . . . . 0.0 111.204 179.117 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -56.44 -47.38 79.22 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 173.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -53.81 -58.08 8.54 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-O 119.167 -0.445 . . . . 0.0 110.975 172.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.0 mt -45.52 -61.18 1.79 Allowed 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 124.291 1.036 . . . . 0.0 110.406 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 14.7 tt -61.06 -50.27 81.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 C-N-CA 120.507 -0.477 . . . . 0.0 109.858 -175.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -61.85 -53.18 59.39 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 121.493 -0.754 . . . . 0.0 112.305 -175.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -67.02 -59.03 3.82 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.988 0.915 . . . . 0.0 109.39 -178.315 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -79.78 -46.67 16.56 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 119.262 -0.399 . . . . 0.0 111.742 -168.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 20.1 mt . . . . . 0 C--O 1.232 0.145 0 CA-C-N 119.001 0.819 . . . . 0.0 109.41 174.166 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 . . . . . 0 C--O 1.225 -0.235 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -30.33 -56.47 0.19 Allowed 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 125.793 1.637 . . . . 0.0 113.382 176.346 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.9 tm-20 -64.89 -41.52 95.55 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.64 0.734 . . . . 0.0 110.384 -173.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 1.1 mp -66.28 -52.74 44.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 N-CA-C 107.053 -1.462 . . . . 0.0 107.053 -177.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 78.6 t -52.89 -41.06 38.72 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 C-N-CA 124.64 1.176 . . . . 0.0 109.777 175.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.7 mptp? -60.53 -51.88 67.54 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 118.988 0.813 . . . . 0.0 110.851 174.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 85.6 mt -52.08 -43.0 63.65 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 119.316 -0.373 . . . . 0.0 110.872 177.036 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 24.7 mmt -68.75 -62.42 1.39 Allowed 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 118.475 0.579 . . . . 0.0 109.94 178.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -45.26 -40.61 7.71 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 127.093 2.157 . . . . 0.0 111.498 -177.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -40.94 -47.31 2.98 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.714 0.806 . . . . 0.0 112.462 175.029 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.1 mp -63.39 -53.86 45.87 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 -178.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -60.95 -34.11 74.23 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 123.625 0.77 . . . . 0.0 111.279 -178.06 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.9 ttm180 . . . . . 0 N--CA 1.449 -0.485 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 173.919 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 . . . . . 0 N--CA 1.454 -0.268 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 11.3 m -103.07 144.31 14.01 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 170.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -86.29 168.4 13.93 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 122.835 0.454 . . . . 0.0 111.158 174.25 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -34.4 -61.31 0.39 Allowed 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 124.547 1.139 . . . . 0.0 112.718 172.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 48.5 tp60 -63.22 -31.66 72.86 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 119.791 1.178 . . . . 0.0 112.072 -174.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -69.68 -42.43 74.14 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 121.305 -0.872 . . . . 0.0 110.022 176.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -54.92 -51.38 66.26 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 170.769 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 26.9 mm -56.25 -40.26 64.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 C-N-CA 123.158 0.583 . . . . 0.0 110.117 176.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 86.2 m -64.6 -39.01 92.96 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 118.926 0.784 . . . . 0.0 110.961 176.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 44.9 t80 -54.95 -53.54 54.29 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 172.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 58.7 mt -59.14 -42.18 90.03 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.962 -0.461 . . . . 0.0 111.83 176.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -62.41 -45.86 95.05 Favored Glycine 0 CA--C 1.525 0.709 0 C-N-CA 124.177 0.894 . . . . 0.0 110.959 -178.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.89 -44.68 84.6 Favored 'General case' 0 N--CA 1.45 -0.458 0 O-C-N 122.182 -0.599 . . . . 0.0 110.061 177.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 13.1 tp -51.18 -57.24 9.28 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.325 0.583 . . . . 0.0 109.899 173.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -48.75 -56.17 9.38 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 114.812 -1.085 . . . . 0.0 109.942 177.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 46.7 ttm -52.33 -54.44 31.55 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 123.916 0.886 . . . . 0.0 111.071 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 42.1 mt -63.49 -45.75 96.98 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 CA-C-O 118.302 -0.856 . . . . 0.0 110.856 -171.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.446 0.1 OUTLIER -83.05 -30.93 27.66 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 -179.844 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 24.3 m-80 -79.8 71.95 6.49 Favored 'General case' 0 C--O 1.236 0.355 0 O-C-N 120.926 -1.109 . . . . 0.0 108.433 170.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -65.0 74.18 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.572 1.549 . . . . 0.0 109.431 175.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -171.89 -47.38 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 128.684 2.794 . . . . 0.0 106.851 -169.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 55.7 mt . . . . . 0 C--N 1.343 0.306 0 N-CA-C 108.412 -0.958 . . . . 0.0 108.412 168.692 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.202 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -49.42 157.31 0.94 Allowed Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 125.459 1.504 . . . . 0.0 110.35 173.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -50.67 -48.42 20.65 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 122.911 2.407 . . . . 0.0 112.213 -174.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.7 mt -55.26 -52.82 62.17 Favored 'General case' 0 C--O 1.225 -0.231 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 172.146 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -58.68 -39.67 81.36 Favored 'General case' 0 C--O 1.225 -0.186 0 CA-C-N 118.243 0.474 . . . . 0.0 110.274 -175.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -64.33 -50.99 65.62 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.503 1.121 . . . . 0.0 110.483 177.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.53 -45.44 94.15 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 121.443 0.639 . . . . 0.0 111.128 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 67.1 mt -53.19 -53.97 20.11 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 169.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.6 -46.96 18.08 Favored Glycine 0 CA--C 1.526 0.775 0 C-N-CA 125.368 1.461 . . . . 0.0 111.986 176.249 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.7 mt -55.45 -56.07 24.4 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 117.635 0.717 . . . . 0.0 110.742 173.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.4 mp -57.59 -42.94 84.21 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 118.973 0.806 . . . . 0.0 111.6 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 77.8 mt -56.97 -55.55 19.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 C-N-CA 123.336 0.654 . . . . 0.0 110.173 174.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.24 -49.68 62.69 Favored Glycine 0 CA--C 1.522 0.527 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 -177.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.5 mm -52.36 -48.71 44.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 C-N-CA 123.242 0.617 . . . . 0.0 110.137 174.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -56.51 -58.2 9.05 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 118.491 0.587 . . . . 0.0 110.47 176.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -54.61 -36.96 65.03 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 125.002 1.321 . . . . 0.0 111.208 -174.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -49.7 -34.43 18.7 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.062 0.945 . . . . 0.0 111.957 177.215 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 -106.62 -47.67 3.71 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.325 0.65 . . . . 0.0 110.837 178.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 22.7 t . . . . . 0 CA--C 1.534 0.329 0 C-N-CA 123.839 0.856 . . . . 0.0 112.422 -177.866 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 45.6 t-80 . . . . . 0 C--O 1.236 0.349 0 CA-C-O 119.683 -0.199 . . . . 0.0 111.429 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 41.3 p -135.04 163.05 30.75 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.899 1.28 . . . . 0.0 110.459 -175.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -159.87 164.95 33.14 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.527 0.731 . . . . 0.0 110.988 169.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 93.6 p -97.97 168.0 10.56 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.462 1.105 . . . . 0.0 113.641 -169.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 13.6 pttm -40.04 -53.19 2.43 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 126.781 2.032 . . . . 0.0 112.617 171.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -54.65 -45.45 73.82 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.39 0.676 . . . . 0.0 109.968 178.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -71.36 -35.79 71.24 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 123.485 0.714 . . . . 0.0 111.073 -176.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 13.3 mt -62.91 -49.35 75.13 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.224 0.92 . . . . 0.0 110.896 170.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -58.03 -46.31 85.52 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 178.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -54.08 -57.17 12.09 Favored 'General case' 0 C--O 1.222 -0.344 0 CA-C-O 119.001 -0.524 . . . . 0.0 110.663 171.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 9.3 mt -45.44 -60.73 2.0 Favored 'General case' 0 N--CA 1.457 -0.09 0 C-N-CA 123.625 0.77 . . . . 0.0 110.48 -178.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 19.8 tt -60.1 -52.98 54.87 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 120.287 -0.565 . . . . 0.0 110.118 -177.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -59.47 -49.88 76.07 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.739 -0.601 . . . . 0.0 112.535 -174.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.11 -53.79 10.14 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.696 0.798 . . . . 0.0 109.815 -176.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 51.8 mm-40 -81.68 -26.62 34.55 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 -167.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 23.9 mt . . . . . 0 CA--C 1.523 -0.083 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 169.243 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 . . . . . 0 CA--C 1.53 0.191 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -35.7 -56.1 0.69 Allowed 'General case' 0 C--O 1.226 -0.14 0 C-N-CA 125.356 1.462 . . . . 0.0 113.148 -175.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -61.69 -41.83 98.11 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.444 0.697 . . . . 0.0 111.18 -176.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.1 mp -63.75 -54.08 36.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 106.852 -1.536 . . . . 0.0 106.852 -178.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 82.5 t -56.84 -41.13 75.22 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-N 115.265 -0.88 . . . . 0.0 109.729 179.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.44 -51.81 68.3 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 118.907 0.776 . . . . 0.0 110.073 177.507 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 44.9 mt -53.87 -41.11 67.16 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 119.361 -0.352 . . . . 0.0 111.404 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.05 -61.68 1.68 Allowed 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 118.642 0.656 . . . . 0.0 109.753 175.324 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -44.37 -36.4 2.82 Favored 'General case' 0 C--O 1.225 -0.205 0 C-N-CA 126.644 1.978 . . . . 0.0 111.949 -177.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -37.38 -46.88 0.81 Allowed 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 125.661 1.584 . . . . 0.0 112.717 178.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -59.27 -49.71 76.8 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 120.665 0.269 . . . . 0.0 110.394 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -64.42 -42.96 95.76 Favored 'General case' 0 C--O 1.225 -0.216 0 C-N-CA 124.089 0.956 . . . . 0.0 110.1 179.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.69 -45.33 70.33 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.697 1.599 . . . . 0.0 109.4 176.64 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 . . . . . 0 C--O 1.227 -0.091 0 C-N-CA 122.94 0.496 . . . . 0.0 112.136 178.563 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 . . . . . 0 N--CA 1.454 -0.257 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 14.5 m -86.57 150.78 3.74 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 171.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 5.2 p30 -91.35 172.78 8.29 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 123.293 0.637 . . . . 0.0 111.86 176.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -41.42 -62.13 0.92 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.258 1.023 . . . . 0.0 113.591 177.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 10.0 tp-100 -65.4 -31.35 72.41 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-N 120.094 1.316 . . . . 0.0 110.808 -177.085 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -64.14 -41.3 97.24 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.175 0.898 . . . . 0.0 110.569 175.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -57.78 -49.76 75.52 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 121.462 -0.774 . . . . 0.0 110.023 169.658 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 21.5 mm -60.07 -26.7 36.96 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 O-C-N 121.787 -0.571 . . . . 0.0 110.782 176.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 52.8 m -75.05 -37.5 61.67 Favored 'General case' 0 C--O 1.225 -0.225 0 O-C-N 120.95 -1.094 . . . . 0.0 110.345 173.072 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 29.1 t80 -55.29 -55.06 35.79 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 118.914 0.779 . . . . 0.0 109.235 170.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 43.9 mt -61.22 -47.3 86.76 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 122.085 -0.385 . . . . 0.0 111.694 177.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -62.1 -41.89 99.71 Favored Glycine 0 CA--C 1.526 0.735 0 N-CA-C 110.946 -0.862 . . . . 0.0 110.946 -175.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.18 -46.5 73.74 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 123.498 0.719 . . . . 0.0 110.268 175.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 18.1 tp -49.97 -53.55 25.73 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 174.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -53.48 -56.83 13.68 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 124.065 0.946 . . . . 0.0 110.394 175.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 40.3 ttm -47.94 -46.62 32.36 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.79 0.836 . . . . 0.0 111.052 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 30.8 mt -72.89 -51.92 24.85 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 CA-C-O 117.908 -1.044 . . . . 0.0 111.379 -176.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.416 0.0 OUTLIER -85.11 -36.46 21.13 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 120.31 1.414 . . . . 0.0 114.711 -175.198 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 32.8 m120 -81.87 62.44 5.66 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 107.259 -1.385 . . . . 0.0 107.259 171.036 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 67.2 mt-10 -44.97 -36.49 3.42 Favored 'General case' 0 C--N 1.339 0.111 0 C-N-CA 126.104 1.762 . . . . 0.0 113.618 -169.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -47.77 -31.93 5.41 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.384 1.074 . . . . 0.0 113.015 178.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 31.6 mt . . . . . 0 C--N 1.34 0.177 0 C-N-CA 122.761 0.424 . . . . 0.0 111.949 174.272 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.315 0 CA-C-O 120.666 0.269 . . . . 0.0 111.178 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.4 m -49.25 158.59 0.72 Allowed Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 124.202 1.001 . . . . 0.0 111.433 170.025 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -47.54 -48.28 15.89 Favored 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 123.354 2.703 . . . . 0.0 113.402 -177.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.0 mt -57.42 -49.24 76.87 Favored 'General case' 0 C--O 1.226 -0.183 0 C-N-CA 120.618 -0.433 . . . . 0.0 112.094 173.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -60.97 -41.57 96.63 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 -175.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 19.8 tt0 -59.77 -51.63 68.93 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.801 0.84 . . . . 0.0 110.677 175.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.35 -45.67 92.15 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.506 0.669 . . . . 0.0 111.271 -177.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 66.1 mt -53.28 -51.75 37.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 169.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.17 -48.2 20.35 Favored Glycine 0 CA--C 1.528 0.86 0 C-N-CA 125.183 1.373 . . . . 0.0 111.835 174.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.3 mt -55.12 -55.25 33.18 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 117.83 0.815 . . . . 0.0 110.795 174.067 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.0 mp -58.2 -41.71 84.6 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.55 0.614 . . . . 0.0 111.715 -179.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 97.1 mt -60.58 -51.33 74.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 C-N-CA 123.494 0.718 . . . . 0.0 110.733 174.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.99 -54.03 36.37 Favored Glycine 0 CA--C 1.521 0.462 0 N-CA-C 109.198 -1.561 . . . . 0.0 109.198 -179.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 7.2 mm -51.51 -50.77 28.3 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 C-N-CA 124.102 0.961 . . . . 0.0 110.375 175.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -50.63 -60.51 2.96 Favored 'General case' 0 C--N 1.339 0.121 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 177.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -59.33 -39.39 82.97 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 121.041 -0.263 . . . . 0.0 111.088 -175.622 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.7 ttpp -53.64 -24.77 15.23 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.096 0.958 . . . . 0.0 111.85 178.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -133.9 42.2 2.95 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 118.461 0.573 . . . . 0.0 110.774 169.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 63.6 p . . . . . 0 N--CA 1.457 -0.114 0 CA-C-O 122.254 1.026 . . . . 0.0 108.487 174.244 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 6.0 p . . . . . 0 CA--C 1.529 0.164 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.2 pp -160.25 -176.31 5.56 Favored 'General case' 0 C--N 1.337 0.024 0 C-N-CA 123.873 0.869 . . . . 0.0 109.533 176.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 87.4 p -152.7 -175.52 5.34 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 119.073 0.851 . . . . 0.0 111.955 -178.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -19.7 -69.56 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 129.381 3.072 . . . . 0.0 113.51 175.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -51.53 -50.63 59.64 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 124.874 1.269 . . . . 0.0 110.568 -177.394 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 14.1 mp0 -64.65 -42.77 95.21 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 119.157 -0.449 . . . . 0.0 109.87 -177.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 71.9 mt -60.99 -50.1 74.76 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.881 0.764 . . . . 0.0 111.21 177.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -59.56 -44.96 93.12 Favored 'General case' 0 CA--C 1.534 0.36 0 O-C-N 121.937 -0.477 . . . . 0.0 110.298 179.117 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 72.0 mt-10 -56.42 -52.36 64.93 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 122.57 0.348 . . . . 0.0 111.197 173.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 16.3 mt -49.51 -54.82 15.83 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.726 0.81 . . . . 0.0 109.471 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 40.7 mm -54.45 -65.87 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 175.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 -57.0 -49.24 76.39 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -169.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.7 -53.76 8.03 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.2 0.6 . . . . 0.0 110.426 -177.291 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -85.22 -16.59 39.73 Favored 'General case' 0 C--N 1.339 0.14 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -168.143 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 94.1 mt . . . . . 0 N--CA 1.458 -0.073 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 168.619 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 . . . . . 0 CA--C 1.532 0.259 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.88 -60.85 0.16 Allowed 'General case' 0 N--CA 1.46 0.038 0 C-N-CA 126.22 1.808 . . . . 0.0 113.3 -177.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -67.64 -38.71 84.25 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.836 -171.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 1.6 mp -61.89 -53.38 48.86 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 N-CA-C 106.164 -1.791 . . . . 0.0 106.164 179.131 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 85.0 t -57.83 -44.46 86.26 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 C-N-CA 124.073 0.949 . . . . 0.0 110.552 -177.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.67 -50.61 73.23 Favored 'General case' 0 CA--C 1.528 0.116 0 CA-C-N 119.262 0.937 . . . . 0.0 111.202 173.263 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 63.2 mt -56.43 -38.22 71.29 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 119.115 -0.469 . . . . 0.0 111.446 178.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 23.3 mmt -69.38 -61.76 1.66 Allowed 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.117 0.871 . . . . 0.0 109.683 175.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -45.88 -40.47 10.04 Favored 'General case' 0 CA--C 1.52 -0.196 0 C-N-CA 126.96 2.104 . . . . 0.0 111.467 -175.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -38.29 -49.97 1.43 Allowed 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.964 1.305 . . . . 0.0 111.546 174.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 77.0 mt -56.69 -50.96 70.59 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 122.495 0.318 . . . . 0.0 110.186 -175.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -69.41 -44.9 70.46 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 123.268 0.627 . . . . 0.0 110.911 -179.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 16.9 ttm180 . . . . . 0 N--CA 1.454 -0.256 0 C-N-CA 124.128 0.971 . . . . 0.0 110.16 -179.065 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 . . . . . 0 N--CA 1.454 -0.247 0 CA-C-O 120.794 0.33 . . . . 0.0 110.987 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.7 m -117.57 160.24 17.24 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 C-N-CA 126.063 1.745 . . . . 0.0 107.955 168.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -105.98 -175.02 2.68 Favored 'General case' 0 CA--C 1.528 0.121 0 C-N-CA 125.102 1.361 . . . . 0.0 111.741 178.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -47.86 -66.14 0.45 Allowed 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 124.328 1.051 . . . . 0.0 112.001 176.069 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.1 tp60 -60.76 -35.56 76.73 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 119.565 1.075 . . . . 0.0 111.453 -173.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -61.61 -47.18 86.61 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.548 -0.72 . . . . 0.0 110.983 175.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -54.74 -50.6 67.99 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.993 -0.442 . . . . 0.0 109.954 172.549 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.405 ' CG2' ' CG2' ' B' ' 74' ' ' ILE . 25.3 mm -57.16 -37.45 55.89 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 C-N-CA 122.97 0.508 . . . . 0.0 110.331 177.533 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 86.6 m -68.09 -39.3 82.91 Favored 'General case' 0 N--CA 1.456 -0.143 0 O-C-N 121.513 -0.742 . . . . 0.0 110.315 177.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 38.0 t80 -56.57 -54.99 39.51 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 173.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 49.2 mt -59.92 -40.0 87.39 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 120.726 0.298 . . . . 0.0 111.476 176.067 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -60.08 -49.64 76.32 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 -179.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.9 -44.96 91.4 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 123.178 0.591 . . . . 0.0 110.25 178.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 11.0 tp -50.52 -57.91 7.0 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.636 0.731 . . . . 0.0 109.734 174.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.45 -53.58 43.66 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 125.037 1.335 . . . . 0.0 110.303 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 39.4 ttm -52.06 -50.06 62.25 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 125.542 1.537 . . . . 0.0 111.026 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 93.3 mt -69.0 -54.9 17.63 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 CA-C-O 118.698 -0.668 . . . . 0.0 110.294 -174.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.451 0.1 OUTLIER -76.14 -35.46 59.21 Favored 'General case' 0 C--N 1.344 0.351 0 C-N-CA 119.051 -1.06 . . . . 0.0 113.398 -173.599 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.4 m-80 -85.13 63.29 8.02 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 106.593 -1.632 . . . . 0.0 106.593 168.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -43.92 -36.77 2.55 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.541 1.136 . . . . 0.0 112.505 -175.729 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.38 -47.46 0.21 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 127.015 2.126 . . . . 0.0 113.165 169.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 20.3 mt . . . . . 0 C--O 1.225 -0.206 0 C-N-CA 123.974 0.91 . . . . 0.0 111.322 178.58 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.294 0 CA-C-O 121.412 0.625 . . . . 0.0 109.488 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -50.41 159.66 0.83 Allowed Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 124.999 1.319 . . . . 0.0 110.841 170.391 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -52.22 -49.35 17.68 Favored 'Trans proline' 0 N--CA 1.459 -0.538 0 C-N-CA 122.599 2.199 . . . . 0.0 112.1 -178.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.7 mt -58.09 -45.68 86.76 Favored 'General case' 0 C--O 1.226 -0.182 0 C-N-CA 120.624 -0.431 . . . . 0.0 111.03 174.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -58.07 -47.36 83.39 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 118.164 0.438 . . . . 0.0 109.835 -177.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 tp60 -60.61 -47.81 84.56 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 122.913 0.485 . . . . 0.0 110.896 177.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.66 -45.74 81.8 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.209 0.528 . . . . 0.0 111.46 -176.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 74.2 mt -54.14 -51.51 46.31 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 170.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.16 -47.46 20.85 Favored Glycine 0 CA--C 1.528 0.869 0 C-N-CA 124.797 1.189 . . . . 0.0 111.889 174.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 mt -56.26 -57.31 12.79 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 117.582 0.691 . . . . 0.0 110.635 174.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.6 mp -57.9 -41.18 82.08 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.047 0.84 . . . . 0.0 111.805 -177.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 74.0 mt -58.22 -56.41 16.27 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 C-N-CA 124.02 0.928 . . . . 0.0 110.741 172.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.64 -50.73 59.17 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 109.942 -1.263 . . . . 0.0 109.942 -176.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.8 mm -51.15 -50.58 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 C-N-CA 124.076 0.95 . . . . 0.0 110.107 173.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -54.05 -57.71 10.03 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 118.107 0.412 . . . . 0.0 110.222 179.088 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 41.9 m-70 -63.43 -29.23 70.55 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -176.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 64.5 tttp -50.45 -33.21 20.21 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 119.061 0.846 . . . . 0.0 111.841 176.096 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -108.62 -44.37 4.07 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.395 0.678 . . . . 0.0 111.083 177.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.2 m . . . . . 0 CA--C 1.53 0.208 0 C-N-CA 123.927 0.891 . . . . 0.0 112.751 -174.429 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 . . . . . 0 CA--C 1.535 0.369 0 CA-C-O 119.236 -0.411 . . . . 0.0 111.829 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 20.2 p -137.93 164.69 28.39 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.442 1.097 . . . . 0.0 111.304 -172.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.5 175.67 12.48 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.801 1.24 . . . . 0.0 109.184 169.507 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.2 t -131.39 -163.17 1.29 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.499 1.12 . . . . 0.0 112.55 -176.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 6.4 mtpm? -39.71 -67.51 0.22 Allowed 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 128.515 2.726 . . . . 0.0 113.461 -169.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -60.94 -46.85 89.03 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 -169.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -54.35 -44.67 72.35 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.48 0.712 . . . . 0.0 110.747 177.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 30.5 mt -65.06 -47.06 78.65 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 118.065 0.393 . . . . 0.0 111.599 178.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 58.5 mttp -57.08 -46.48 82.5 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.647 175.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -57.66 -49.36 76.74 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 122.955 0.502 . . . . 0.0 110.397 175.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 10.4 mt -48.16 -53.47 16.68 Favored 'General case' 0 CA--C 1.527 0.09 0 CA-C-N 119.15 0.886 . . . . 0.0 110.25 178.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 39.8 mt -57.84 -62.09 1.08 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.297 175.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -50.04 -46.87 53.44 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.484 0.714 . . . . 0.0 112.534 -172.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 9.1 mmpt? -81.43 -52.33 7.38 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 125.342 1.457 . . . . 0.0 110.451 -172.198 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -95.75 -16.83 21.68 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 -168.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 54.3 mt . . . . . 0 C--N 1.335 -0.033 0 C-N-CA 125.309 1.444 . . . . 0.0 108.154 173.712 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 18.0 p-10 . . . . . 0 N--CA 1.463 0.221 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.42 -61.33 0.14 Allowed 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 126.895 2.078 . . . . 0.0 113.831 -177.135 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -67.18 -38.71 85.86 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 120.804 0.335 . . . . 0.0 111.282 -172.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 2.1 mp -63.18 -53.89 40.31 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 N-CA-C 106.861 -1.533 . . . . 0.0 106.861 179.057 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 79.6 t -55.31 -45.35 77.79 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 C-N-CA 124.309 1.044 . . . . 0.0 110.134 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -58.17 -52.45 65.52 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 118.97 0.805 . . . . 0.0 110.203 176.364 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 62.9 mt -54.79 -39.5 68.51 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 119.43 -0.319 . . . . 0.0 111.418 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.83 -67.35 0.48 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 118.484 0.583 . . . . 0.0 109.524 173.727 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -39.62 -41.2 1.01 Allowed 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 127.364 2.266 . . . . 0.0 112.092 -176.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -37.88 -49.89 1.24 Allowed 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.162 1.385 . . . . 0.0 112.158 176.039 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -65.75 -33.7 76.47 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 111.699 0.259 . . . . 0.0 111.699 -174.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -76.8 -53.1 8.37 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 177.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 14.3 ttm180 -48.0 -41.57 25.7 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.311 1.044 . . . . 0.0 110.686 177.276 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 . . . . . 0 N--CA 1.454 -0.236 0 C-N-CA 123.911 0.884 . . . . 0.0 109.916 -178.298 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 64.8 mm-40 . . . . . 0 N--CA 1.452 -0.356 0 N-CA-C 106.042 -1.836 . . . . 0.0 106.042 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 12.3 m -79.25 142.28 14.22 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 176.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -82.41 170.31 15.44 Favored 'General case' 0 N--CA 1.461 0.108 0 C-N-CA 122.917 0.487 . . . . 0.0 111.578 177.395 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -35.37 -63.02 0.37 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.051 1.34 . . . . 0.0 112.82 173.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 10.1 tp-100 -64.53 -32.37 73.98 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 120.35 1.432 . . . . 0.0 111.817 -175.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -66.29 -39.38 89.32 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 120.966 -1.084 . . . . 0.0 110.274 176.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.03 -48.59 79.61 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 121.713 -0.617 . . . . 0.0 109.622 169.776 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.405 ' CG2' ' CG2' ' A' ' 74' ' ' ILE . 20.0 mm -62.18 -23.89 33.16 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 O-C-N 121.612 -0.68 . . . . 0.0 110.891 175.638 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 39.7 m -77.88 -33.72 51.89 Favored 'General case' 0 C--O 1.224 -0.273 0 O-C-N 120.762 -1.211 . . . . 0.0 110.426 171.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -60.16 -55.77 29.72 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.298 -0.876 . . . . 0.0 108.977 170.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 45.4 mt -62.8 -41.62 99.36 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-O 121.035 0.445 . . . . 0.0 111.773 177.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.9 -43.27 96.27 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.598 -1.001 . . . . 0.0 110.598 -178.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.55 -46.29 86.64 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.349 0.66 . . . . 0.0 110.209 174.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 6.8 tp -50.41 -58.14 6.39 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.403 0.621 . . . . 0.0 109.83 174.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.5 -52.81 35.1 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.86 1.264 . . . . 0.0 110.21 178.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 57.1 ttm -57.14 -47.43 81.17 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 124.19 0.996 . . . . 0.0 111.139 -178.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 97.1 mt -65.42 -58.63 6.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 -176.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.448 1.1 p90 -67.09 -40.58 86.99 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 118.218 -1.393 . . . . 0.0 112.501 -174.489 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 28.3 m-80 -81.71 66.98 7.51 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 169.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -44.0 -35.44 2.07 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.842 1.257 . . . . 0.0 113.815 -171.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -32.84 -53.3 0.34 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.537 1.535 . . . . 0.0 112.246 168.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 69.1 mt . . . . . 0 CA--C 1.534 0.351 0 N-CA-C 113.787 1.032 . . . . 0.0 113.787 -171.648 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.292 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 40.0 p -73.68 170.58 13.68 Favored Pre-proline 0 N--CA 1.451 -0.38 0 C-N-CA 123.206 0.602 . . . . 0.0 110.059 175.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -50.58 -43.93 42.77 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.299 1.999 . . . . 0.0 110.658 168.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.8 mt -53.38 -61.06 2.54 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-O 119.234 -0.412 . . . . 0.0 111.531 170.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -56.9 -39.22 74.01 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 118.495 0.589 . . . . 0.0 111.172 -174.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 -61.19 -51.04 70.67 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.782 0.833 . . . . 0.0 110.686 175.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.22 -44.9 95.52 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.454 0.702 . . . . 0.0 111.323 -178.682 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 95.4 mt -54.87 -52.26 44.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 171.08 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.3 -47.43 21.71 Favored Glycine 0 CA--C 1.526 0.759 0 C-N-CA 125.309 1.433 . . . . 0.0 111.929 175.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 mt -55.14 -54.74 39.38 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 117.739 0.77 . . . . 0.0 110.43 174.022 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.6 mp -58.84 -44.17 90.89 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 119.344 0.975 . . . . 0.0 111.756 -179.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 88.5 mt -55.94 -56.53 12.24 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 C-N-CA 123.398 0.679 . . . . 0.0 110.304 174.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.19 -50.08 64.15 Favored Glycine 0 CA--C 1.522 0.471 0 N-CA-C 110.046 -1.221 . . . . 0.0 110.046 -176.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 8.8 mm -52.94 -47.86 52.54 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 C-N-CA 123.465 0.706 . . . . 0.0 110.139 175.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -55.25 -65.15 0.64 Allowed 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 118.432 0.56 . . . . 0.0 109.74 177.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 25.5 m-70 -61.92 -26.79 68.39 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 118.41 -0.805 . . . . 0.0 113.018 -172.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 65.1 tttp -49.21 -35.99 18.78 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 119.366 0.984 . . . . 0.0 111.107 171.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 71.7 m-85 -103.6 -56.34 2.23 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 122.994 0.518 . . . . 0.0 110.084 177.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 C--O 1.225 -0.231 0 C-N-CA 122.988 0.515 . . . . 0.0 111.924 -176.257 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.449 -0.509 0 CA-C-O 120.916 0.389 . . . . 0.0 110.374 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.56 173.5 15.42 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.099 0.96 . . . . 0.0 109.171 173.057 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 54.5 p -117.94 171.97 7.72 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 123.596 0.759 . . . . 0.0 112.28 -172.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.7 pttm -31.74 -49.17 0.16 Allowed 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 127.197 2.199 . . . . 0.0 113.416 169.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.5 -54.83 42.55 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.411 0.624 . . . . 0.0 109.533 -177.109 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.2 mp0 -60.62 -41.91 95.8 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.339 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 69.6 mt -59.16 -48.77 80.37 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 118.447 0.567 . . . . 0.0 111.405 178.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -62.6 -31.57 72.43 Favored 'General case' 0 N--CA 1.457 -0.122 0 C-N-CA 123.397 0.679 . . . . 0.0 110.881 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.43 -68.83 0.34 Allowed 'General case' 0 C--O 1.22 -0.463 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 167.052 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.3 mt -30.13 -65.65 0.11 Allowed 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 126.075 1.75 . . . . 0.0 113.266 -177.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 20.0 tt -59.34 -51.94 66.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.231 -175.105 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -57.84 -45.76 85.74 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 125.208 1.403 . . . . 0.0 111.91 -177.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.0 mmpt? -72.21 -48.89 39.6 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 124.982 1.313 . . . . 0.0 110.263 -175.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -92.58 -52.77 4.48 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.306 0.642 . . . . 0.0 111.052 -169.201 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 31.9 mt . . . . . 0 C--N 1.335 -0.05 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 172.793 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 . . . . . 0 CA--C 1.533 0.299 0 N-CA-C 112.473 0.545 . . . . 0.0 112.473 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.31 -59.99 0.14 Allowed 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 126.984 2.114 . . . . 0.0 114.421 -176.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -63.63 -43.33 97.13 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 121.119 0.485 . . . . 0.0 110.332 -173.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 2.5 mp -63.1 -51.2 74.58 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 107.264 -1.384 . . . . 0.0 107.264 -178.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 72.7 t -55.11 -49.32 72.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 C-N-CA 123.554 0.742 . . . . 0.0 109.867 178.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -53.79 -53.07 57.5 Favored 'General case' 0 CA--C 1.527 0.092 0 CA-C-N 118.826 0.739 . . . . 0.0 110.595 176.338 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.4 mt -51.14 -43.0 61.12 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 119.34 -0.362 . . . . 0.0 111.737 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.48 -68.07 0.48 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 118.411 0.55 . . . . 0.0 109.85 175.38 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -43.86 -35.12 1.83 Allowed 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 128.037 2.535 . . . . 0.0 112.689 -174.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -38.39 -48.68 1.38 Allowed 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 124.738 1.215 . . . . 0.0 112.585 171.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -65.21 -36.7 84.99 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 117.877 0.308 . . . . 0.0 111.349 -176.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -71.04 -43.99 66.71 Favored 'General case' 0 C--O 1.226 -0.135 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 179.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 22.5 ttm105 . . . . . 0 CA--C 1.53 0.188 0 C-N-CA 123.195 0.598 . . . . 0.0 110.18 175.918 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 . . . . . 0 CA--C 1.531 0.226 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.6 m -119.13 149.21 21.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 169.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.8 p30 -93.2 169.15 10.61 Favored 'General case' 0 C--O 1.232 0.169 0 C-N-CA 123.677 0.791 . . . . 0.0 110.096 172.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -34.63 -59.0 0.48 Allowed 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 124.95 1.3 . . . . 0.0 113.261 176.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 34.6 tp60 -68.2 -29.25 68.05 Favored 'General case' 0 CA--C 1.528 0.116 0 O-C-N 120.848 -1.158 . . . . 0.0 111.464 -173.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.2 -31.7 66.12 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.408 -0.808 . . . . 0.0 110.063 174.085 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -61.16 -47.26 87.02 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.365 -0.834 . . . . 0.0 109.254 167.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 26.5 mm -59.96 -29.48 43.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 O-C-N 121.784 -0.572 . . . . 0.0 110.586 174.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 28.6 m -72.38 -39.15 68.25 Favored 'General case' 0 C--O 1.225 -0.195 0 O-C-N 121.26 -0.9 . . . . 0.0 111.225 172.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 48.1 t80 -58.83 -54.71 43.98 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 118.88 0.764 . . . . 0.0 109.454 174.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 29.2 mt -59.46 -44.97 92.88 Favored 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 122.477 0.311 . . . . 0.0 111.068 175.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -60.4 -39.86 96.79 Favored Glycine 0 CA--C 1.524 0.651 0 C-N-CA 123.727 0.679 . . . . 0.0 111.464 -178.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.99 -49.64 56.05 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.819 0.848 . . . . 0.0 110.057 176.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -47.38 -53.8 12.9 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.607 0.763 . . . . 0.0 109.731 173.632 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -54.62 -60.65 3.07 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 124.669 1.187 . . . . 0.0 110.6 176.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 53.9 ttm -48.93 -45.28 41.4 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 124.037 0.935 . . . . 0.0 111.333 -178.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 57.4 mt -65.82 -60.09 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-O 118.482 -0.77 . . . . 0.0 109.901 -178.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.379 0.0 OUTLIER -76.64 -31.61 57.48 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 113.96 1.096 . . . . 0.0 113.96 -172.67 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.7 m120 -82.39 58.02 3.92 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 169.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -39.53 -40.44 0.86 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 127.251 2.22 . . . . 0.0 115.046 -168.285 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -45.9 -38.41 7.45 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.914 1.286 . . . . 0.0 112.375 178.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 93.0 mt . . . . . 0 CA--C 1.533 0.318 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 179.983 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.319 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.5 m -47.58 156.68 0.63 Allowed Pre-proline 0 CA--C 1.534 0.343 0 C-N-CA 126.245 1.818 . . . . 0.0 112.323 -179.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -41.65 -49.75 5.15 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 123.947 3.098 . . . . 0.0 114.25 -177.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 4.5 mt -56.19 -51.08 69.34 Favored 'General case' 0 N--CA 1.457 -0.111 0 N-CA-C 113.175 0.806 . . . . 0.0 113.175 172.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -61.68 -36.68 81.58 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 118.353 0.524 . . . . 0.0 109.85 -178.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -59.97 -53.8 53.57 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 124.396 1.078 . . . . 0.0 109.551 175.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.05 -47.41 86.53 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.102 0.961 . . . . 0.0 111.148 -178.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 72.0 mt -52.84 -53.0 23.37 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 170.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -49.29 -44.57 35.08 Favored Glycine 0 CA--C 1.525 0.676 0 C-N-CA 125.45 1.5 . . . . 0.0 111.882 176.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.1 mt -59.32 -54.45 46.67 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.651 0.78 . . . . 0.0 110.89 174.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 mp -58.49 -43.36 88.97 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 118.911 0.778 . . . . 0.0 111.43 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 85.4 mt -57.73 -52.65 55.04 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.207 0 C-N-CA 123.739 0.816 . . . . 0.0 110.611 173.012 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.25 -50.18 60.63 Favored Glycine 0 CA--C 1.523 0.551 0 N-CA-C 109.788 -1.325 . . . . 0.0 109.788 -177.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.9 mm -54.2 -50.81 53.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 C-N-CA 123.391 0.676 . . . . 0.0 110.387 175.216 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . 0.404 ' HB2' ' CE2' ' B' ' 73' ' ' TYR . 39.7 t80 -53.43 -56.59 15.58 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 121.699 0.762 . . . . 0.0 110.862 177.75 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 44.1 t60 -63.85 -37.4 87.25 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 124.573 1.149 . . . . 0.0 110.696 -171.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -49.67 -49.3 47.98 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.913 0.885 . . . . 0.0 110.91 175.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -88.42 -33.39 17.9 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 122.277 -0.264 . . . . 0.0 111.121 -174.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 14.6 m . . . . . 0 CA--C 1.536 0.414 0 CA-C-N 118.346 0.521 . . . . 0.0 110.721 175.564 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 18.0 m80 . . . . . 0 CA--C 1.538 0.517 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 59.3 p -139.57 158.61 43.83 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.725 1.61 . . . . 0.0 107.624 172.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -161.4 179.01 8.61 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.057 171.457 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.3 t -135.68 -165.74 1.74 Allowed 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.659 1.118 . . . . 0.0 112.441 -176.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 24.1 pttm -47.14 -52.05 16.52 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 126.575 1.95 . . . . 0.0 112.618 -170.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 18.8 tptp -52.1 -51.31 58.55 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 124.247 1.019 . . . . 0.0 110.825 178.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 27.9 mp0 -69.21 -36.5 77.31 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.282 -176.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 19.2 mt -66.03 -47.67 73.62 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 118.842 0.746 . . . . 0.0 111.429 176.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -57.69 -48.72 78.76 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 175.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 58.2 mt-10 -53.04 -58.34 7.32 Favored 'General case' 0 C--O 1.222 -0.384 0 CA-C-O 119.363 -0.351 . . . . 0.0 110.914 172.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 10.2 mt -44.46 -62.56 1.14 Allowed 'General case' 0 CA--C 1.521 -0.165 0 C-N-CA 124.521 1.128 . . . . 0.0 110.229 179.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 15.3 tt -63.35 -47.01 93.96 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 C-N-CA 120.064 -0.654 . . . . 0.0 110.449 -174.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 16.0 tt0 -60.13 -49.34 78.02 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.409 -0.807 . . . . 0.0 111.717 -177.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -73.85 -52.15 13.94 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.838 0.855 . . . . 0.0 109.766 -175.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -85.15 -18.75 33.19 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -169.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 15.6 mt . . . . . 0 CA--C 1.53 0.192 0 C-N-CA 124.605 1.162 . . . . 0.0 108.364 175.214 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 . . . . . 0 CA--C 1.53 0.187 0 CA-C-O 120.537 0.208 . . . . 0.0 110.556 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -37.69 -56.47 1.06 Allowed 'General case' 0 C--O 1.225 -0.209 0 C-N-CA 125.383 1.473 . . . . 0.0 113.874 -171.002 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -61.21 -40.36 93.67 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.275 0.56 . . . . 0.0 110.88 -175.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 2.4 mp -68.44 -49.85 62.1 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 N-CA-C 106.873 -1.528 . . . . 0.0 106.873 -177.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 92.9 t -53.83 -45.06 62.12 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.263 0 C-N-CA 123.239 0.616 . . . . 0.0 110.141 175.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -57.17 -52.74 64.09 Favored 'General case' 0 CA--C 1.527 0.075 0 CA-C-N 118.715 0.689 . . . . 0.0 110.235 175.512 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 30.9 mt -52.51 -41.36 63.37 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 119.038 -0.505 . . . . 0.0 111.419 178.375 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 27.6 mmt -68.94 -61.9 1.61 Allowed 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.926 0.785 . . . . 0.0 109.914 176.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -44.11 -36.38 2.57 Favored 'General case' 0 CA--C 1.522 -0.131 0 C-N-CA 127.724 2.41 . . . . 0.0 111.899 -177.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -38.86 -49.42 1.65 Allowed 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 124.542 1.137 . . . . 0.0 112.061 175.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -57.87 -53.77 54.49 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.342 0.519 . . . . 0.0 109.909 -178.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -60.95 -39.63 90.25 Favored 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 124.352 1.061 . . . . 0.0 111.011 -178.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 36.0 ttm-85 -62.36 -54.94 33.06 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.473 0.709 . . . . 0.0 109.902 178.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 . . . . . 0 CA--C 1.52 -0.206 0 CA-C-O 119.642 -0.218 . . . . 0.0 111.138 -173.4 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 10.7 mp0 . . . . . 0 N--CA 1.453 -0.279 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 33.7 m -79.58 155.17 4.67 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 172.464 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 3.5 p30 -101.07 171.96 7.31 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.638 0.733 . . . . 0.0 110.527 171.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -31.8 -58.35 0.28 Allowed 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 126.627 1.971 . . . . 0.0 113.65 178.061 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 44.3 tp60 -65.9 -39.14 90.34 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.943 1.247 . . . . 0.0 112.201 -169.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -69.37 -38.78 78.22 Favored 'General case' 0 C--O 1.234 0.248 0 O-C-N 121.57 -0.706 . . . . 0.0 109.732 177.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 73' ' ' TYR . . . . . 0.404 ' CE2' ' HB2' ' B' ' 16' ' ' PHE . 1.0 OUTLIER -54.96 -55.47 30.37 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 171.77 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 19.3 mm -50.59 -48.34 26.89 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.26 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 178.336 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 34.2 m -59.88 -20.87 59.7 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -179.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 15.3 t80 -61.25 -49.31 77.62 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 119.48 1.036 . . . . 0.0 108.398 169.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 44.2 mt -71.3 -39.48 71.43 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.164 0.986 . . . . 0.0 110.936 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -58.31 -50.03 70.47 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.025 -1.23 . . . . 0.0 110.025 176.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.2 -45.68 93.58 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 122.817 0.447 . . . . 0.0 110.638 175.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 14.8 tp -51.46 -56.07 15.35 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.087 0.47 . . . . 0.0 110.075 177.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.42 -58.78 5.31 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 124.323 1.049 . . . . 0.0 109.896 175.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 55.6 ttm -50.63 -44.97 57.51 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.93 0.892 . . . . 0.0 111.315 -176.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 98.6 mt -70.19 -62.3 1.34 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 118.322 -0.846 . . . . 0.0 110.822 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.427 0.1 OUTLIER -71.38 -38.97 71.47 Favored 'General case' 0 C--N 1.347 0.476 0 C-N-CA 118.691 -1.204 . . . . 0.0 112.676 -170.919 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -85.98 62.54 7.51 Favored 'General case' 0 C--N 1.335 -0.048 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 168.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -42.72 -36.84 1.56 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.709 1.604 . . . . 0.0 112.573 -176.233 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -31.87 -49.68 0.18 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 126.804 2.042 . . . . 0.0 112.7 169.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 17.3 mt . . . . . 0 C--O 1.226 -0.183 0 C-N-CA 124.561 1.144 . . . . 0.0 112.608 -179.592 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.214 0 CA-C-O 121.866 0.841 . . . . 0.0 110.202 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 14.9 m -64.5 164.5 19.38 Favored Pre-proline 0 CA--C 1.539 0.557 0 C-N-CA 125.137 1.375 . . . . 0.0 110.013 -176.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_exo -47.61 -47.95 16.87 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 123.171 2.58 . . . . 0.0 113.042 -178.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.2 mt -56.4 -47.49 78.89 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-O 119.195 -0.431 . . . . 0.0 112.036 173.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -61.66 -41.34 97.41 Favored 'General case' 0 C--O 1.227 -0.11 0 CA-C-N 118.717 0.689 . . . . 0.0 109.649 -176.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.5 tt0 -62.03 -49.78 74.64 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 122.855 0.462 . . . . 0.0 110.826 175.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.8 -46.34 89.97 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.534 0.683 . . . . 0.0 111.423 -178.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 68.8 mt -53.7 -52.31 35.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.196 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 170.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.87 -47.35 19.25 Favored Glycine 0 CA--C 1.526 0.769 0 C-N-CA 125.204 1.383 . . . . 0.0 111.88 175.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 mt -55.69 -54.86 39.13 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 117.706 0.753 . . . . 0.0 110.958 173.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.11 -44.35 87.65 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 118.809 0.731 . . . . 0.0 111.742 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 83.1 mt -56.81 -53.8 37.59 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 C-N-CA 123.422 0.689 . . . . 0.0 110.003 174.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -53.88 -50.22 55.45 Favored Glycine 0 CA--C 1.523 0.538 0 N-CA-C 110.111 -1.196 . . . . 0.0 110.111 -178.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 7.3 mm -55.33 -46.48 78.29 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 123.269 0.628 . . . . 0.0 110.513 176.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -56.23 -57.88 10.31 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 118.738 0.699 . . . . 0.0 110.233 175.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -56.41 -37.14 69.76 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 124.158 0.983 . . . . 0.0 111.234 -175.352 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -51.04 -32.16 20.77 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.801 1.24 . . . . 0.0 111.903 178.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -108.61 -53.44 2.64 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.108 0.563 . . . . 0.0 110.233 177.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 23.1 t . . . . . 0 CA--C 1.53 0.208 0 C-N-CA 123.458 0.703 . . . . 0.0 110.921 -179.267 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 41.6 p . . . . . 0 N--CA 1.451 -0.382 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -161.36 170.8 19.42 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.548 1.139 . . . . 0.0 108.212 169.144 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 59.9 p -127.22 173.97 9.31 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 119.343 0.974 . . . . 0.0 112.482 -169.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.4 ptmm? -26.48 -55.9 0.08 Allowed 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 128.339 2.656 . . . . 0.0 114.565 175.074 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -55.63 -55.65 29.58 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 123.457 0.703 . . . . 0.0 110.233 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 7.7 mp0 -62.59 -35.64 80.16 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-O 118.949 -0.548 . . . . 0.0 110.49 -179.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 51.7 mt -66.69 -50.22 63.58 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 118.755 0.707 . . . . 0.0 111.217 178.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -59.77 -43.73 94.22 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 110.094 -0.335 . . . . 0.0 110.094 177.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -55.9 -64.83 0.73 Allowed 'General case' 0 C--O 1.219 -0.508 0 CA-C-O 118.467 -0.778 . . . . 0.0 109.646 170.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.3 mt -35.56 -62.16 0.42 Allowed 'General case' 0 N--CA 1.461 0.112 0 C-N-CA 125.42 1.488 . . . . 0.0 111.499 179.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 9.2 tt -60.81 -51.58 71.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 120.292 -0.563 . . . . 0.0 109.866 -174.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -60.61 -42.4 96.76 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.588 -0.695 . . . . 0.0 112.443 -177.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -72.67 -55.04 7.42 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.93 1.292 . . . . 0.0 109.534 -175.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -85.97 -24.97 26.3 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.735 0.814 . . . . 0.0 113.005 -168.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 67.9 mt . . . . . 0 C--N 1.338 0.099 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 168.441 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.0 p30 . . . . . 0 N--CA 1.462 0.125 0 CA-C-O 119.237 -0.411 . . . . 0.0 111.283 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -34.16 -57.98 0.47 Allowed 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 125.181 1.392 . . . . 0.0 113.81 -173.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 77.1 tt0 -66.04 -40.94 91.42 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.975 0.51 . . . . 0.0 111.486 -174.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 2.2 mp -63.05 -52.69 56.0 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.46 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 77.6 t -54.36 -48.27 68.42 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 C-N-CA 123.975 0.91 . . . . 0.0 109.877 177.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -53.56 -52.94 58.1 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 118.871 0.759 . . . . 0.0 111.112 177.091 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 30.9 mt -52.59 -42.88 64.92 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 119.378 -0.344 . . . . 0.0 111.462 -179.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.52 -63.54 1.1 Allowed 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 118.457 0.571 . . . . 0.0 109.873 176.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -38.93 -46.35 1.3 Allowed 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 127.327 2.251 . . . . 0.0 111.818 -177.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -38.91 -48.81 1.62 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.701 1.2 . . . . 0.0 112.6 177.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.1 mp -57.39 -51.56 68.91 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 -177.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -65.94 -40.99 91.87 Favored 'General case' 0 C--O 1.225 -0.231 0 C-N-CA 122.654 0.382 . . . . 0.0 110.764 179.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 12.7 ttp180 . . . . . 0 N--CA 1.453 -0.284 0 C-N-CA 122.842 0.457 . . . . 0.0 110.568 -178.072 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 21.1 mp0 . . . . . 0 N--CA 1.45 -0.473 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.7 m -83.19 150.71 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 176.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -89.64 177.07 6.63 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 123.267 0.627 . . . . 0.0 110.693 175.058 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -44.43 -60.86 1.75 Allowed 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.84 0.856 . . . . 0.0 111.861 174.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.0 tp60 -62.49 -35.81 80.53 Favored 'General case' 0 C--O 1.225 -0.19 0 CA-C-N 119.376 0.989 . . . . 0.0 111.822 -173.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -65.51 -40.53 93.12 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 119.519 1.054 . . . . 0.0 111.277 174.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -55.62 -51.77 66.07 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.801 -0.562 . . . . 0.0 109.525 170.345 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 29.0 mm -56.53 -39.91 65.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 O-C-N 122.029 -0.419 . . . . 0.0 110.335 177.216 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 84.8 m -64.19 -39.59 94.31 Favored 'General case' 0 C--O 1.226 -0.151 0 O-C-N 121.614 -0.679 . . . . 0.0 110.384 178.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -55.27 -53.33 57.45 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 173.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 61.7 mt -60.32 -42.35 95.42 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.673 -0.24 . . . . 0.0 111.572 177.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -62.31 -46.9 92.93 Favored Glycine 0 CA--C 1.526 0.768 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 -179.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.6 -48.83 77.72 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 122.173 -0.604 . . . . 0.0 109.758 177.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 16.7 tp -50.37 -57.96 6.78 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.72 0.772 . . . . 0.0 110.029 176.052 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -48.42 -54.88 12.46 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 125.109 1.364 . . . . 0.0 109.955 177.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 9.1 ttp -59.99 -48.31 82.24 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 123.342 0.657 . . . . 0.0 111.655 -176.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 93.7 mt -59.55 -54.28 36.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 CA-C-O 118.135 -0.936 . . . . 0.0 110.128 -179.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.439 1.3 p90 -76.41 -38.72 55.18 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 120.097 1.317 . . . . 0.0 113.309 -175.742 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 27.8 m-80 -79.88 74.19 6.62 Favored 'General case' 0 N--CA 1.463 0.206 0 O-C-N 121.008 -1.058 . . . . 0.0 108.552 173.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -36.33 -43.19 0.36 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.309 1.444 . . . . 0.0 113.512 176.695 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -39.97 -41.96 1.29 Allowed 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.11 1.764 . . . . 0.0 113.54 174.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 47.6 mt . . . . . 0 CA--C 1.528 0.129 0 CA-C-O 118.864 -0.589 . . . . 0.0 112.349 -178.505 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.265 0 CA-C-O 120.81 0.338 . . . . 0.0 111.005 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.1 m -54.89 163.23 1.53 Allowed Pre-proline 0 CA--C 1.54 0.587 0 C-N-CA 124.686 1.194 . . . . 0.0 111.698 175.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -46.89 -50.33 10.99 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 123.597 2.864 . . . . 0.0 113.185 179.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.2 mt -54.73 -48.6 72.34 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-O 119.476 -0.297 . . . . 0.0 111.535 173.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -61.4 -42.38 98.63 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 118.315 0.507 . . . . 0.0 109.973 -176.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.2 tp60 -63.64 -47.22 82.23 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 122.367 0.267 . . . . 0.0 110.922 176.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.5 -47.19 82.75 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 121.339 0.59 . . . . 0.0 110.869 -178.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 69.5 mt -52.68 -55.34 11.76 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.248 0 N-CA-C 108.075 -1.084 . . . . 0.0 108.075 169.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -45.77 -45.97 13.41 Favored Glycine 0 CA--C 1.526 0.772 0 C-N-CA 125.352 1.453 . . . . 0.0 112.079 177.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.2 mt -55.72 -55.92 26.6 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.493 0.717 . . . . 0.0 110.782 173.371 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.9 mp -58.51 -43.03 88.97 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 118.898 0.772 . . . . 0.0 111.863 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 52.1 mt -57.48 -57.76 8.88 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 C-N-CA 123.435 0.694 . . . . 0.0 109.938 174.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.06 -48.84 61.53 Favored Glycine 0 CA--C 1.521 0.421 0 N-CA-C 109.968 -1.253 . . . . 0.0 109.968 -177.164 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 5.8 mm -54.22 -46.88 68.32 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 C-N-CA 123.515 0.726 . . . . 0.0 110.878 175.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -56.62 -61.42 2.44 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 118.719 0.69 . . . . 0.0 109.32 175.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -55.02 -37.33 66.51 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.727 0.811 . . . . 0.0 111.771 -173.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -45.68 -38.95 7.35 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.289 1.435 . . . . 0.0 111.197 175.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -101.56 -60.15 1.58 Allowed 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 176.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.5 m . . . . . 0 C--N 1.338 0.091 0 C-N-CA 123.845 0.858 . . . . 0.0 112.617 -173.061 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 11.9 t-80 . . . . . 0 CA--C 1.535 0.399 0 CA-C-O 120.217 0.056 . . . . 0.0 110.994 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 1.1 p -129.65 160.99 31.62 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 125.374 1.469 . . . . 0.0 110.715 -173.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -156.51 161.37 40.02 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.081 0.552 . . . . 0.0 111.449 169.496 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 75.5 m -108.2 158.76 17.16 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.649 1.18 . . . . 0.0 113.145 -174.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 14.5 ptpt -22.64 -58.35 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 129.048 2.939 . . . . 0.0 115.397 179.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 18.2 tppt? -46.52 -50.04 17.72 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.24 1.016 . . . . 0.0 111.094 179.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 80.1 mt-10 -69.67 -27.94 65.45 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 119.037 -0.506 . . . . 0.0 111.847 -178.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 19.7 mt -73.9 -46.37 44.92 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 119.153 0.888 . . . . 0.0 110.049 176.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 39.0 mttp -56.16 -47.87 77.41 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 172.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -55.04 -56.62 17.77 Favored 'General case' 0 C--O 1.223 -0.336 0 CA-C-O 119.044 -0.503 . . . . 0.0 111.037 172.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 11.1 mt -45.95 -59.56 2.76 Favored 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 123.38 0.672 . . . . 0.0 110.299 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 15.5 tt -62.91 -50.76 78.36 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 C-N-CA 119.8 -0.76 . . . . 0.0 110.197 -177.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -59.35 -51.1 71.39 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.078 -1.014 . . . . 0.0 112.302 -175.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.1 -52.82 12.82 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.736 0.815 . . . . 0.0 110.208 -177.091 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -88.99 -18.15 27.97 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 -167.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 42.6 mt . . . . . 0 CA--C 1.526 0.054 0 C-N-CA 125.255 1.422 . . . . 0.0 107.874 172.843 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 18.1 p-10 . . . . . 0 C--O 1.225 -0.231 0 CA-C-O 119.675 -0.203 . . . . 0.0 111.054 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -42.52 -54.45 3.9 Favored 'General case' 0 C--O 1.225 -0.188 0 C-N-CA 123.912 0.885 . . . . 0.0 113.182 -169.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -59.42 -43.46 93.05 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.675 0.79 . . . . 0.0 110.848 -178.058 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.2 mp -63.22 -52.53 57.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 N-CA-C 106.927 -1.508 . . . . 0.0 106.927 -178.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 84.7 t -56.72 -43.93 80.43 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 C-N-CA 124.248 1.019 . . . . 0.0 110.295 179.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -57.29 -53.7 55.17 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 119.023 0.829 . . . . 0.0 110.03 175.13 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 30.8 mt -51.88 -44.16 63.62 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 119.184 -0.436 . . . . 0.0 111.088 178.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 27.2 mmt -65.97 -65.31 0.69 Allowed 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 109.524 -0.546 . . . . 0.0 109.524 176.116 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -40.72 -43.09 1.89 Allowed 'General case' 0 CA--C 1.52 -0.196 0 C-N-CA 127.826 2.45 . . . . 0.0 111.89 -175.155 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -38.7 -48.76 1.52 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.21 1.004 . . . . 0.0 112.312 176.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.4 pp -61.85 -37.84 85.99 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 117.915 0.325 . . . . 0.0 111.479 -175.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -76.18 -47.15 25.19 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 179.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 14.1 ttm180 -50.57 -41.46 54.34 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.244 0.617 . . . . 0.0 110.283 177.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 . . . . . 0 CA--C 1.532 0.275 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -179.714 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 . . . . . 0 N--CA 1.451 -0.386 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 5.3 m -118.77 149.86 21.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 C-N-CA 124.991 1.316 . . . . 0.0 107.619 172.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -86.84 174.62 8.66 Favored 'General case' 0 CA--C 1.527 0.093 0 C-N-CA 124.272 1.029 . . . . 0.0 111.79 176.219 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 49.3 t80 -46.31 -61.91 1.58 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.717 0.807 . . . . 0.0 113.156 178.015 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 10.1 tp-100 -63.8 -32.49 74.02 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 120.183 1.356 . . . . 0.0 111.071 -177.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -62.61 -41.7 99.14 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 119.533 1.061 . . . . 0.0 110.938 175.079 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -57.96 -50.51 73.14 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.769 -0.582 . . . . 0.0 109.892 169.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 23.9 mm -60.18 -25.21 32.79 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 O-C-N 121.655 -0.653 . . . . 0.0 111.04 176.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 60.8 m -77.88 -32.94 52.15 Favored 'General case' 0 C--O 1.224 -0.24 0 O-C-N 120.917 -1.115 . . . . 0.0 110.37 173.4 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 30.8 t80 -58.46 -55.25 37.47 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 170.293 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 53.1 mt -63.09 -43.19 99.21 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 121.411 0.624 . . . . 0.0 111.7 178.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.88 -43.7 97.18 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.685 -0.966 . . . . 0.0 110.685 -177.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.29 -46.74 85.37 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 123.186 0.595 . . . . 0.0 110.031 174.253 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 13.8 tp -49.55 -56.18 10.82 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.426 0.631 . . . . 0.0 109.963 175.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.81 -58.63 5.87 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 114.624 -1.171 . . . . 0.0 110.384 177.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 48.3 ttm -51.01 -48.4 61.43 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 124.889 1.276 . . . . 0.0 110.983 -177.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 76.6 mt -63.8 -66.07 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 CA-C-O 118.8 -0.619 . . . . 0.0 109.458 -178.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.381 0.7 OUTLIER -70.13 -31.29 68.74 Favored 'General case' 0 C--N 1.345 0.411 0 C-N-CA 117.941 -1.504 . . . . 0.0 112.715 -169.764 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 22.5 m-80 -80.61 71.73 7.5 Favored 'General case' 0 C--O 1.231 0.12 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 170.03 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -35.75 -45.22 0.37 Allowed 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 125.821 1.648 . . . . 0.0 112.158 178.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -35.74 -48.61 0.55 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.968 1.707 . . . . 0.0 113.426 174.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 96.4 mt . . . . . 0 CA--C 1.532 0.26 0 C-N-CA 123.002 0.521 . . . . 0.0 112.393 -176.332 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.284 0 CA-C-O 121.0 0.429 . . . . 0.0 110.917 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.4 t -44.87 155.63 0.39 Allowed Pre-proline 0 CA--C 1.534 0.336 0 C-N-CA 124.989 1.316 . . . . 0.0 111.08 169.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -50.23 -38.92 52.45 Favored 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 122.331 2.021 . . . . 0.0 111.533 169.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.9 mt -61.28 -54.0 49.62 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 118.649 0.659 . . . . 0.0 110.142 173.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -58.35 -38.96 78.26 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 117.656 0.207 . . . . 0.0 110.832 -175.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 15.1 tt0 -64.02 -52.3 60.12 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 124.783 1.233 . . . . 0.0 110.615 176.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.34 -45.42 91.29 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 121.367 0.603 . . . . 0.0 111.098 -178.126 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 68.0 mt -52.63 -52.63 25.43 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 169.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.4 -47.47 16.78 Favored Glycine 0 CA--C 1.528 0.893 0 C-N-CA 125.204 1.383 . . . . 0.0 112.202 174.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.6 mt -56.89 -55.31 36.08 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 117.95 0.875 . . . . 0.0 110.8 174.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.9 mp -59.37 -42.8 92.47 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 118.707 0.685 . . . . 0.0 111.7 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 73.5 mt -55.94 -56.82 10.71 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.167 0 C-N-CA 123.959 0.904 . . . . 0.0 109.746 172.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.29 -48.58 63.5 Favored Glycine 0 CA--C 1.522 0.518 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 -176.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 6.3 mm -54.73 -46.63 74.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 C-N-CA 123.396 0.678 . . . . 0.0 110.527 175.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -57.95 -53.45 58.04 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.645 0.736 . . . . 0.0 110.187 175.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.5 t-80 -57.43 -36.61 71.58 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.673 0.789 . . . . 0.0 111.302 -175.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.8 ttmm -52.86 -28.5 23.29 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.026 1.33 . . . . 0.0 111.87 178.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 61.3 m-85 -117.61 -73.52 0.64 Allowed 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.36 0.664 . . . . 0.0 109.602 176.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.455 -0.182 0 C-N-CA 124.513 1.125 . . . . 0.0 110.432 -175.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.5 p . . . . . 0 CA--C 1.53 0.191 0 CA-C-O 121.161 0.505 . . . . 0.0 112.178 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.48 -172.31 3.5 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.411 1.484 . . . . 0.0 108.178 171.178 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 8.6 t -148.17 -168.93 3.21 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 119.899 1.227 . . . . 0.0 111.828 178.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 49.0 pttt -35.15 -57.14 0.58 Allowed 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 128.992 2.917 . . . . 0.0 114.376 -173.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 23.1 ttmm -58.3 -52.37 65.88 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 -177.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -63.22 -40.48 97.59 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.274 -176.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.2 mt -59.77 -52.71 64.32 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 118.133 0.424 . . . . 0.0 111.178 175.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 35.3 mtmm -59.91 -43.36 94.92 Favored 'General case' 0 CA--C 1.531 0.212 0 O-C-N 122.202 -0.311 . . . . 0.0 110.706 -179.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 85.1 mt-10 -56.87 -60.22 3.89 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-O 118.746 -0.645 . . . . 0.0 109.8 172.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.0 mt -40.11 -60.6 1.02 Allowed 'General case' 0 N--CA 1.461 0.096 0 C-N-CA 124.481 1.113 . . . . 0.0 111.323 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 18.3 tt -60.94 -51.54 72.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 C-N-CA 120.179 -0.608 . . . . 0.0 110.29 -177.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -59.92 -47.55 85.3 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 118.868 0.758 . . . . 0.0 111.815 -175.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.2 mmpt? -67.95 -57.98 5.29 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 125.539 1.535 . . . . 0.0 109.642 -176.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -83.25 -49.23 9.63 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.198 -168.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 15.0 mt . . . . . 0 C--O 1.231 0.086 0 N-CA-C 108.056 -1.091 . . . . 0.0 108.056 171.207 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.1 p30 . . . . . 0 CA--C 1.528 0.133 0 CA-C-O 119.463 -0.303 . . . . 0.0 111.761 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.92 -60.5 0.16 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.124 1.77 . . . . 0.0 115.115 -176.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -62.55 -40.18 95.99 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-O 121.421 0.629 . . . . 0.0 110.845 -174.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.4 mp -67.54 -48.42 76.94 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 -178.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 84.6 t -55.13 -44.66 75.53 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.36 0 CA-C-O 118.791 -0.623 . . . . 0.0 110.294 176.357 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -57.09 -52.68 64.33 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 119.339 0.972 . . . . 0.0 110.577 174.01 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 39.7 mt -52.99 -42.12 65.26 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 119.06 -0.495 . . . . 0.0 111.557 178.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 25.4 mmt -68.63 -61.56 1.77 Allowed 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.886 0.766 . . . . 0.0 109.554 176.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -46.12 -36.04 5.51 Favored 'General case' 0 CA--C 1.521 -0.143 0 C-N-CA 127.639 2.375 . . . . 0.0 111.973 -176.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -39.16 -56.75 1.43 Allowed 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.831 0.853 . . . . 0.0 111.605 170.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.25 -50.08 74.85 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 -176.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -58.25 -54.9 41.73 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.522 0.729 . . . . 0.0 111.189 -177.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 16.9 ptt180 . . . . . 0 N--CA 1.454 -0.266 0 O-C-N 122.493 -0.129 . . . . 0.0 110.789 -173.154 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.8 mp0 . . . . . 0 N--CA 1.451 -0.38 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 33.9 m -105.73 154.56 6.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 108.239 -1.022 . . . . 0.0 108.239 170.071 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -93.35 178.11 5.82 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 123.946 0.898 . . . . 0.0 110.967 177.114 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 50.3 t80 -40.51 -65.41 0.42 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.756 1.222 . . . . 0.0 112.538 172.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -61.21 -36.54 80.19 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 120.074 1.306 . . . . 0.0 111.844 -175.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 -66.55 -32.87 74.48 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 120.956 -1.09 . . . . 0.0 111.628 176.089 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -61.61 -51.89 66.65 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 121.19 -0.944 . . . . 0.0 108.559 168.499 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 21.3 mm -53.02 -39.69 33.91 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.364 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 177.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 54.6 m -59.1 -32.83 70.18 Favored 'General case' 0 C--O 1.226 -0.167 0 C-N-CA 123.744 0.818 . . . . 0.0 111.301 177.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -56.97 -50.55 72.3 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 171.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 42.9 mt -69.83 -39.82 76.24 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.018 0.927 . . . . 0.0 111.755 -177.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.72 -43.04 77.45 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 109.925 -1.27 . . . . 0.0 109.925 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.47 -45.95 88.44 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 122.104 -0.644 . . . . 0.0 110.202 173.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 10.0 tp -50.53 -57.69 7.54 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.04 0.536 . . . . 0.0 109.708 173.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -49.67 -54.14 20.36 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 124.072 0.949 . . . . 0.0 110.533 177.12 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 48.1 ttm -56.16 -47.94 77.27 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 124.248 1.019 . . . . 0.0 110.906 -177.116 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 85.5 mt -65.48 -55.43 20.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.477 -177.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.444 0.1 OUTLIER -75.22 -35.8 61.44 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 119.911 1.232 . . . . 0.0 112.997 -174.408 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 31.9 m-80 -81.75 72.85 8.8 Favored 'General case' 0 N--CA 1.461 0.105 0 O-C-N 120.942 -1.099 . . . . 0.0 108.123 170.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -30.17 -50.77 0.13 Allowed 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 126.633 1.973 . . . . 0.0 112.837 -179.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -34.11 -54.46 0.49 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.202 1.801 . . . . 0.0 113.146 174.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 94.7 mt . . . . . 0 N--CA 1.454 -0.249 0 C-N-CA 124.086 0.954 . . . . 0.0 113.245 -173.617 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.267 0 CA-C-O 121.267 0.556 . . . . 0.0 110.066 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -71.07 170.29 11.94 Favored Pre-proline 0 CA--C 1.539 0.526 0 C-N-CA 124.616 1.167 . . . . 0.0 111.101 -169.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -49.09 -49.01 16.37 Favored 'Trans proline' 0 N--CA 1.459 -0.554 0 C-N-CA 123.313 2.675 . . . . 0.0 112.428 179.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.5 mt -53.7 -50.9 64.88 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 119.32 -0.372 . . . . 0.0 111.551 172.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -59.38 -41.23 88.86 Favored 'General case' 0 C--O 1.227 -0.11 0 CA-C-N 118.539 0.608 . . . . 0.0 110.285 -177.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -61.66 -50.32 72.98 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 122.832 0.453 . . . . 0.0 110.69 176.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.21 -46.13 90.8 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.597 0.759 . . . . 0.0 111.164 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 78.5 mt -55.64 -50.87 64.18 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 172.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.69 -47.68 18.11 Favored Glycine 0 CA--C 1.527 0.787 0 C-N-CA 125.295 1.426 . . . . 0.0 111.896 174.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.3 mt -55.52 -54.59 42.06 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 117.538 0.669 . . . . 0.0 111.087 173.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.5 mp -58.21 -42.76 86.93 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 118.851 0.751 . . . . 0.0 111.616 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 97.4 mt -56.98 -53.32 44.48 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.168 0 C-N-CA 123.204 0.602 . . . . 0.0 110.082 173.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.77 -50.06 59.42 Favored Glycine 0 CA--C 1.522 0.525 0 N-CA-C 110.33 -1.108 . . . . 0.0 110.33 -178.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.8 mm -55.02 -45.84 76.96 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 C-N-CA 122.607 0.363 . . . . 0.0 110.28 175.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 39.7 t80 -56.94 -57.8 10.92 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 118.537 0.608 . . . . 0.0 110.111 176.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -51.66 -41.39 61.33 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 124.497 1.119 . . . . 0.0 111.128 -177.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 65.3 tttp -50.24 -32.63 17.12 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.337 1.055 . . . . 0.0 112.293 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -113.66 -55.17 2.54 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.495 0.718 . . . . 0.0 110.643 179.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 4.6 t . . . . . 0 C--O 1.232 0.139 0 C-N-CA 124.159 0.984 . . . . 0.0 111.247 -178.481 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 16.8 t-160 . . . . . 0 CA--C 1.539 0.523 0 CA-C-O 119.551 -0.261 . . . . 0.0 110.343 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 35.9 p -122.34 153.09 39.45 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 124.723 1.209 . . . . 0.0 112.609 -179.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -155.12 -174.68 5.08 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.672 1.589 . . . . 0.0 107.919 170.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 9.1 t -147.02 -167.47 2.78 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 120.155 1.343 . . . . 0.0 112.63 -177.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -39.96 -53.87 2.28 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 127.725 2.41 . . . . 0.0 113.474 -169.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -56.87 -50.57 72.09 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 123.015 0.526 . . . . 0.0 110.754 -179.042 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 19.4 mp0 -65.48 -38.1 88.78 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 -177.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 31.6 mt -66.45 -51.26 58.75 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 118.214 0.461 . . . . 0.0 111.268 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -54.91 -48.96 72.38 Favored 'General case' 0 N--CA 1.456 -0.175 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 176.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -52.61 -60.55 3.11 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 119.062 -0.494 . . . . 0.0 111.019 173.164 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 9.1 mt -43.04 -64.19 0.67 Allowed 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 124.466 1.106 . . . . 0.0 110.494 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 18.3 tt -63.22 -51.09 75.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 119.677 -0.809 . . . . 0.0 110.491 -174.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -67.91 -33.51 74.84 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.405 -0.809 . . . . 0.0 112.549 -171.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.43 -68.16 0.67 Allowed 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 174.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 60.8 mm-40 -64.25 -44.38 91.96 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 122.158 -0.339 . . . . 0.0 110.667 -168.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 26.3 mt . . . . . 0 N--CA 1.456 -0.144 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 172.235 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 . . . . . 0 C--O 1.226 -0.166 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -33.55 -60.83 0.35 Allowed 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 125.87 1.668 . . . . 0.0 114.142 -178.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 62.8 tt0 -58.91 -41.39 87.14 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-O 120.959 0.409 . . . . 0.0 110.852 -178.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -64.59 -53.23 44.91 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.644 0 N-CA-C 106.665 -1.606 . . . . 0.0 106.665 -175.363 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 92.2 t -54.9 -45.58 75.62 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 C-N-CA 124.168 0.987 . . . . 0.0 110.082 177.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -55.75 -53.17 59.88 Favored 'General case' 0 CA--C 1.528 0.106 0 CA-C-N 118.538 0.608 . . . . 0.0 110.876 174.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 60.3 mt -55.85 -39.86 72.04 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 118.97 -0.538 . . . . 0.0 111.153 179.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 26.4 mmt -65.78 -65.6 0.66 Allowed 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.859 0.754 . . . . 0.0 109.186 174.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -39.3 -45.93 1.49 Allowed 'General case' 0 N--CA 1.461 0.124 0 C-N-CA 127.393 2.277 . . . . 0.0 111.892 -178.315 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -38.95 -48.3 1.57 Allowed 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 125.127 1.371 . . . . 0.0 112.227 178.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.2 pp -60.04 -39.89 87.52 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-O 119.641 -0.218 . . . . 0.0 110.827 -175.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -80.26 -42.81 22.47 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 123.005 0.522 . . . . 0.0 110.506 -178.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 54.7 ttm-85 -53.65 -45.73 70.32 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.328 0.651 . . . . 0.0 110.037 177.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 14.5 m-80 . . . . . 0 N--CA 1.456 -0.146 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 178.38 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 26.6 mp0 . . . . . 0 N--CA 1.452 -0.37 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 15.3 m -115.97 153.05 17.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 N-CA-C 106.106 -1.813 . . . . 0.0 106.106 167.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -96.82 174.83 6.6 Favored 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 123.085 0.554 . . . . 0.0 110.728 174.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -39.9 -60.23 1.05 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.065 0.946 . . . . 0.0 112.54 171.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 61.4 tp60 -60.48 -39.28 87.09 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 119.827 1.194 . . . . 0.0 111.835 -176.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 50.6 mm-40 -62.84 -41.37 99.32 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.322 -0.861 . . . . 0.0 111.339 174.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -56.7 -48.88 76.7 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.44 -0.787 . . . . 0.0 109.718 172.434 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 26.2 mm -59.42 -34.39 54.27 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 C-N-CA 123.725 0.81 . . . . 0.0 110.552 176.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 74.5 m -67.01 -41.91 85.88 Favored 'General case' 0 C--O 1.227 -0.121 0 O-C-N 121.479 -0.763 . . . . 0.0 110.204 174.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -56.72 -52.04 66.48 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.432 0.693 . . . . 0.0 109.225 174.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 44.0 mt -58.83 -44.64 90.96 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 122.246 -0.284 . . . . 0.0 111.59 175.042 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -59.5 -46.13 94.45 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 -179.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.09 -48.96 77.86 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 123.395 0.678 . . . . 0.0 109.804 176.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -50.69 -58.5 5.73 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-O 122.176 0.988 . . . . 0.0 109.733 176.201 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -48.69 -55.63 10.81 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 125.368 1.467 . . . . 0.0 110.742 178.126 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 19.7 ttp -66.58 -39.63 88.54 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.458 0.703 . . . . 0.0 112.087 -175.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 63.6 mt -65.49 -43.99 94.25 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 CA-C-O 118.02 -0.99 . . . . 0.0 110.079 -177.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.463 0.9 OUTLIER -78.75 -40.06 34.45 Favored 'General case' 0 C--N 1.347 0.459 0 C-N-CA 118.363 -1.335 . . . . 0.0 113.349 175.132 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -80.09 66.84 5.71 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 120.853 -1.154 . . . . 0.0 108.732 170.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -38.06 -42.65 0.67 Allowed 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.739 1.616 . . . . 0.0 113.328 -177.456 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -32.34 -55.07 0.33 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.25 1.82 . . . . 0.0 112.854 170.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 89.2 mt . . . . . 0 C--O 1.222 -0.368 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 -173.213 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.23 0 CA-C-O 121.546 0.688 . . . . 0.0 110.907 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.08 168.18 1.68 Allowed Pre-proline 0 CA--C 1.538 0.503 0 C-N-CA 126.598 1.959 . . . . 0.0 112.246 -178.384 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -49.05 -51.54 10.4 Favored 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 123.297 2.665 . . . . 0.0 112.491 174.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.8 mt -58.26 -49.18 78.02 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 119.436 -0.316 . . . . 0.0 110.705 176.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -54.99 -47.76 74.21 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -177.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 16.0 tt0 -59.72 -51.66 68.84 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.884 0.874 . . . . 0.0 110.757 177.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.33 -46.68 85.52 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.464 0.706 . . . . 0.0 111.725 -175.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 75.2 mt -54.21 -53.19 31.19 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 N-CA-C 107.958 -1.126 . . . . 0.0 107.958 170.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -45.6 -47.64 12.6 Favored Glycine 0 CA--C 1.529 0.92 0 C-N-CA 124.742 1.163 . . . . 0.0 112.087 175.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 mt -56.62 -54.3 47.63 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.785 0.834 . . . . 0.0 111.007 174.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.4 mp -60.03 -44.25 94.77 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.067 0.849 . . . . 0.0 111.743 -179.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 67.7 mt -56.18 -55.67 17.35 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 C-N-CA 123.238 0.615 . . . . 0.0 109.733 173.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -52.77 -50.73 48.54 Favored Glycine 0 CA--C 1.521 0.417 0 N-CA-C 110.03 -1.228 . . . . 0.0 110.03 -177.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.7 mm -55.0 -48.44 75.74 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 C-N-CA 123.03 0.532 . . . . 0.0 110.443 176.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -55.16 -56.15 23.2 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 118.668 0.667 . . . . 0.0 110.245 177.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -64.28 -31.96 73.37 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 123.19 0.596 . . . . 0.0 111.5 -172.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -49.77 -43.84 48.48 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.544 1.138 . . . . 0.0 110.828 176.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 94.5 m-85 -96.12 -56.05 2.77 Favored 'General case' 0 CA--C 1.529 0.138 0 N-CA-C 109.624 -0.509 . . . . 0.0 109.624 179.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.8 m . . . . . 0 C--O 1.224 -0.267 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -175.572 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.4 p . . . . . 0 N--CA 1.447 -0.616 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -161.61 163.2 30.12 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.829 0.852 . . . . 0.0 108.73 168.77 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 10.6 t -116.96 -169.64 1.68 Allowed 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.229 0.922 . . . . 0.0 112.639 -174.063 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -38.61 -65.49 0.35 Allowed 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 128.942 2.897 . . . . 0.0 113.252 -171.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 30.1 tttm -56.14 -43.54 78.36 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.386 0.674 . . . . 0.0 110.742 -174.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -66.41 -39.44 88.99 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 123.697 0.799 . . . . 0.0 110.387 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 45.8 mt -63.1 -50.65 69.66 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 118.123 0.42 . . . . 0.0 110.822 174.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 36.3 mttp -53.42 -49.26 67.69 Favored 'General case' 0 C--O 1.233 0.185 0 C-N-CA 123.584 0.754 . . . . 0.0 110.061 176.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 53.2 tt0 -51.56 -69.56 0.11 Allowed 'General case' 0 C--O 1.223 -0.335 0 CA-C-O 118.308 -0.853 . . . . 0.0 109.196 171.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.6 mt -35.26 -63.47 0.33 Allowed 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 124.126 0.971 . . . . 0.0 112.476 178.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 14.7 tt -63.85 -45.27 97.54 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-O 119.118 -0.468 . . . . 0.0 110.579 -171.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.0 tt0 -70.42 -44.75 67.28 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 118.856 0.753 . . . . 0.0 111.904 -176.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.7 mmpt? -54.85 -58.35 7.94 Favored 'General case' 0 N--CA 1.458 -0.069 0 C-N-CA 124.236 1.015 . . . . 0.0 109.103 175.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -79.56 -66.66 0.84 Allowed 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.715 -171.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 95.9 mt . . . . . 0 N--CA 1.453 -0.31 0 O-C-N 121.615 -0.678 . . . . 0.0 109.916 -175.067 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 . . . . . 0 CA--C 1.534 0.338 0 N-CA-C 114.552 1.316 . . . . 0.0 114.552 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -38.64 -56.2 1.35 Allowed 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.442 1.497 . . . . 0.0 113.737 -173.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -63.44 -38.93 93.04 Favored 'General case' 0 N--CA 1.461 0.106 0 CA-C-O 121.267 0.556 . . . . 0.0 110.709 -174.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.0 mp -68.65 -49.47 64.42 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.705 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 -175.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 71.6 t -53.5 -47.39 59.6 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 C-N-CA 123.342 0.657 . . . . 0.0 110.172 173.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.54 -52.63 63.06 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.73 0.695 . . . . 0.0 110.607 176.212 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.1 mt -55.27 -40.47 71.03 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.266 0.626 . . . . 0.0 111.547 -178.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.24 -61.49 1.77 Allowed 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 118.563 0.62 . . . . 0.0 109.645 174.491 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -46.61 -34.0 4.63 Favored 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 126.5 1.92 . . . . 0.0 112.269 -176.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -38.12 -50.39 1.38 Allowed 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 125.302 1.441 . . . . 0.0 111.43 173.212 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -53.03 -60.53 3.17 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 122.81 0.444 . . . . 0.0 109.872 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -63.34 -40.28 96.85 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.569 0.747 . . . . 0.0 111.467 -174.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.534 0.344 0 CA-C-O 119.485 -0.293 . . . . 0.0 111.761 -173.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.5 pm0 . . . . . 0 N--CA 1.448 -0.539 0 CA-C-O 120.684 0.278 . . . . 0.0 111.312 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 20.5 m -107.69 149.1 11.31 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 C-N-CA 126.034 1.734 . . . . 0.0 108.303 174.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -87.68 168.93 12.56 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.335 0.654 . . . . 0.0 111.283 175.214 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -33.59 -63.0 0.27 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.688 1.195 . . . . 0.0 112.963 172.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 45.2 tp60 -62.49 -31.46 72.22 Favored 'General case' 0 CA--C 1.533 0.292 0 O-C-N 120.753 -1.217 . . . . 0.0 111.839 -174.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -71.8 -37.74 70.36 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.261 -0.899 . . . . 0.0 110.199 176.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -56.67 -49.86 73.81 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 169.666 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 26.9 mm -56.59 -41.43 73.5 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 175.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 60.1 m -59.22 -41.7 89.26 Favored 'General case' 0 C--O 1.225 -0.196 0 CA-C-N 118.821 0.737 . . . . 0.0 110.489 177.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -54.46 -54.62 38.46 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 122.027 -0.421 . . . . 0.0 109.885 174.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 62.4 mt -61.12 -40.7 94.78 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.95 -44.48 67.66 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 110.386 -1.086 . . . . 0.0 110.386 -176.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.02 -44.3 93.0 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 117.942 0.871 . . . . 0.0 110.302 175.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 14.4 tp -50.94 -57.1 9.41 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 121.278 0.561 . . . . 0.0 109.659 173.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.36 -47.32 66.21 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.312 178.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 37.2 ttm -58.49 -46.64 86.25 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 123.963 0.905 . . . . 0.0 110.798 -179.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 63.6 mt -63.51 -62.99 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.162 0 CA-C-O 118.554 -0.736 . . . . 0.0 109.886 176.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.452 0.2 OUTLIER -68.16 -34.74 76.88 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 118.025 -1.47 . . . . 0.0 112.731 -169.868 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -83.91 66.84 9.34 Favored 'General case' 0 N--CA 1.462 0.149 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 167.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 82.9 mt-10 -41.78 -39.31 1.7 Allowed 'General case' 0 N--CA 1.463 0.209 0 C-N-CA 125.904 1.681 . . . . 0.0 112.028 -173.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.17 -50.94 0.31 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.848 1.659 . . . . 0.0 113.419 171.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 59.5 mt . . . . . 0 CA--C 1.533 0.326 0 C-N-CA 123.926 0.89 . . . . 0.0 113.32 -174.663 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.255 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 3.8 m -55.66 161.5 3.16 Favored Pre-proline 0 CA--C 1.54 0.559 0 C-N-CA 123.211 0.605 . . . . 0.0 110.797 174.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -44.26 -49.64 8.58 Favored 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 123.615 2.877 . . . . 0.0 113.285 178.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 6.1 mt -53.99 -47.82 71.02 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-O 119.643 -0.218 . . . . 0.0 111.466 174.158 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -64.93 -42.29 94.8 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 109.8 -0.445 . . . . 0.0 109.8 -174.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 tp60 -61.46 -46.69 89.01 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 122.179 0.192 . . . . 0.0 110.682 175.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.84 -46.88 83.06 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.411 0.685 . . . . 0.0 111.165 -178.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 57.8 mt -52.54 -51.99 29.95 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 C-N-CA 124.177 0.991 . . . . 0.0 108.448 169.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.68 -48.46 23.17 Favored Glycine 0 CA--C 1.528 0.874 0 C-N-CA 124.971 1.272 . . . . 0.0 111.654 175.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 mt -56.03 -54.51 44.03 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 117.492 0.646 . . . . 0.0 111.027 174.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 mp -57.94 -44.81 87.16 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.053 0.842 . . . . 0.0 111.666 -179.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 96.2 mt -56.32 -54.01 33.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 C-N-CA 123.171 0.588 . . . . 0.0 110.263 173.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.27 -50.19 57.01 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 110.293 -1.123 . . . . 0.0 110.293 -178.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 9.1 mm -53.85 -48.52 62.12 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 C-N-CA 123.684 0.794 . . . . 0.0 110.549 176.019 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -55.47 -62.28 1.78 Allowed 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.326 0.584 . . . . 0.0 109.686 176.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -52.7 -41.16 63.64 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.312 1.045 . . . . 0.0 111.427 -174.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -47.58 -39.96 17.97 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.713 1.205 . . . . 0.0 111.43 178.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -96.89 -62.48 1.25 Allowed 'General case' 0 C--O 1.233 0.199 0 N-CA-C 109.044 -0.725 . . . . 0.0 109.044 178.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.4 m . . . . . 0 C--O 1.232 0.172 0 C-N-CA 124.135 0.974 . . . . 0.0 111.975 -173.516 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 45.2 m80 . . . . . 0 CA--C 1.537 0.476 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -138.63 160.22 40.14 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 126.039 1.735 . . . . 0.0 107.412 176.724 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.53 176.87 11.12 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-O 118.998 -0.525 . . . . 0.0 110.938 176.369 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 39.1 p -125.71 174.0 8.62 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.701 0.682 . . . . 0.0 112.491 -174.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 11.3 ptpt -26.39 -56.65 0.08 Allowed 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 127.889 2.476 . . . . 0.0 113.981 170.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -53.78 -52.58 59.79 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 123.136 0.574 . . . . 0.0 110.551 -178.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 26.0 mp0 -67.8 -37.2 81.7 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 118.693 -0.67 . . . . 0.0 110.391 -178.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 62.3 mt -62.11 -51.96 65.8 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.266 0.939 . . . . 0.0 111.108 178.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -61.93 -42.13 98.75 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 122.987 0.515 . . . . 0.0 110.002 -179.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 58.9 mt-10 -54.87 -67.01 0.3 Allowed 'General case' 0 C--O 1.222 -0.353 0 CA-C-O 119.302 -0.38 . . . . 0.0 110.299 169.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 12.7 mt -37.61 -63.38 0.46 Allowed 'General case' 0 CA--C 1.52 -0.184 0 C-N-CA 125.98 1.712 . . . . 0.0 111.224 -179.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 13.6 tt -57.26 -54.38 31.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.158 -174.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 -73.7 -31.32 63.35 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.994 0.738 . . . . 0.0 112.994 -170.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.9 -56.98 4.2 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 176.336 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 68.9 mm-40 -77.06 -26.65 53.8 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 117.911 -1.042 . . . . 0.0 112.628 -168.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 95.5 mt . . . . . 0 C--N 1.339 0.11 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 167.538 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 . . . . . 0 C--O 1.225 -0.229 0 N-CA-C 114.111 1.152 . . . . 0.0 114.111 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -28.7 -60.13 0.13 Allowed 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 126.453 1.901 . . . . 0.0 113.561 -178.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -67.65 -39.81 84.56 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-O 120.889 0.376 . . . . 0.0 110.603 -172.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.1 mp -62.05 -54.1 38.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 N-CA-C 106.931 -1.507 . . . . 0.0 106.931 179.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 70.9 t -58.71 -40.99 81.14 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 C-N-CA 124.452 1.101 . . . . 0.0 110.116 -177.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -58.19 -54.67 44.35 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 118.916 0.78 . . . . 0.0 110.307 172.198 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 36.7 mt -51.87 -41.87 62.21 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 119.231 -0.414 . . . . 0.0 111.606 178.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 24.0 mmt -69.56 -64.56 0.86 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 121.533 0.683 . . . . 0.0 109.988 177.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.65 -25.5 62.82 Favored 'General case' 0 N--CA 1.457 -0.088 0 C-N-CA 124.791 1.236 . . . . 0.0 112.293 -169.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -41.29 -50.09 3.69 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 124.273 1.029 . . . . 0.0 111.166 168.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 78.4 mt -59.08 -53.28 60.15 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -174.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -60.7 -44.03 97.07 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 124.582 1.153 . . . . 0.0 110.948 -179.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 29.4 ttm105 -59.05 -52.75 64.41 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.407 0.683 . . . . 0.0 110.108 178.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 . . . . . 0 N--CA 1.454 -0.232 0 CA-C-N 116.663 -0.244 . . . . 0.0 110.372 -171.778 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 . . . . . 0 CA--C 1.531 0.213 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 15.2 m -106.39 150.96 8.57 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 C-N-CA 124.697 1.199 . . . . 0.0 108.807 174.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -90.82 174.14 7.62 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.861 0.864 . . . . 0.0 110.826 173.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -39.06 -62.11 0.68 Allowed 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.019 1.328 . . . . 0.0 112.883 173.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 39.0 tp60 -61.84 -35.33 77.94 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 119.603 1.092 . . . . 0.0 111.605 -173.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -66.21 -43.42 86.77 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.667 -0.646 . . . . 0.0 110.139 176.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -54.67 -48.33 72.5 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.867 -0.52 . . . . 0.0 109.896 171.806 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 25.5 mm -58.55 -37.8 66.95 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 O-C-N 121.889 -0.507 . . . . 0.0 110.355 175.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 37.5 m -62.99 -42.86 99.96 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 121.521 -0.737 . . . . 0.0 110.203 175.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -56.14 -55.07 37.54 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 122.958 0.503 . . . . 0.0 110.017 176.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 39.6 mt -60.64 -44.28 96.58 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 122.188 -0.32 . . . . 0.0 111.861 177.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.56 -39.64 95.64 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 111.059 -0.816 . . . . 0.0 111.059 -175.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.32 -50.53 72.56 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 117.541 0.67 . . . . 0.0 109.425 173.118 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -49.39 -54.69 16.07 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 121.445 0.64 . . . . 0.0 109.894 174.658 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.08 -56.85 11.8 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 124.487 1.115 . . . . 0.0 110.716 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 11.4 ttp -60.74 -45.55 93.85 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.656 0.782 . . . . 0.0 111.315 -177.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 63.3 mt -61.97 -47.75 91.74 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-O 117.916 -1.04 . . . . 0.0 110.216 -175.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.453 0.0 OUTLIER -83.2 -31.58 27.0 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 179.89 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 32.0 m-80 -80.11 77.55 6.81 Favored 'General case' 0 N--CA 1.462 0.126 0 O-C-N 120.715 -1.241 . . . . 0.0 108.749 173.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 55.0 mm-40 -36.71 -43.29 0.41 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 126.024 1.729 . . . . 0.0 112.466 178.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -41.46 -41.19 1.99 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 126.185 1.794 . . . . 0.0 113.734 176.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 90.5 mt . . . . . 0 CA--C 1.531 0.23 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -177.278 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.196 0 CA-C-O 121.894 0.854 . . . . 0.0 109.706 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 13.6 m -60.01 160.87 14.2 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 125.93 1.692 . . . . 0.0 109.717 -177.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo -48.61 -49.41 14.79 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.977 2.451 . . . . 0.0 112.92 -176.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.6 mt -58.83 -41.25 86.45 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 173.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -63.04 -40.79 98.77 Favored 'General case' 0 C--O 1.225 -0.201 0 CA-C-N 118.979 0.809 . . . . 0.0 109.389 -178.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -60.24 -51.87 67.72 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 122.753 0.421 . . . . 0.0 110.427 174.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.56 -46.87 88.59 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 121.563 0.697 . . . . 0.0 111.639 -177.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 60.6 mt -55.23 -50.8 61.6 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 171.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -48.06 -46.96 26.79 Favored Glycine 0 CA--C 1.526 0.747 0 C-N-CA 125.157 1.361 . . . . 0.0 111.688 176.029 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.6 mt -54.85 -55.93 24.95 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.775 0.83 . . . . 0.0 110.916 173.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 11.0 mp -60.35 -43.87 96.08 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.546 -0.721 . . . . 0.0 111.914 -179.025 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 96.1 mt -55.34 -56.16 13.04 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.206 0 C-N-CA 123.226 0.611 . . . . 0.0 109.592 173.431 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -52.77 -49.72 52.78 Favored Glycine 0 CA--C 1.522 0.483 0 N-CA-C 110.356 -1.098 . . . . 0.0 110.356 -177.271 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 7.9 mm -53.4 -46.94 59.05 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 C-N-CA 122.694 0.398 . . . . 0.0 110.84 176.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 29.3 t80 -58.87 -60.35 3.98 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 121.939 0.876 . . . . 0.0 109.8 176.342 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.1 t-80 -55.41 -34.14 64.15 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 125.468 1.507 . . . . 0.0 111.871 -172.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 65.3 tttp -46.68 -36.69 7.37 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.586 1.154 . . . . 0.0 111.567 174.425 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -104.88 -62.61 1.32 Allowed 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 176.002 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.5 m . . . . . 0 C--O 1.226 -0.138 0 C-N-CA 124.74 1.216 . . . . 0.0 112.705 -171.911 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 36.4 p . . . . . 0 N--CA 1.466 0.369 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -145.65 -172.84 3.98 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.413 1.085 . . . . 0.0 108.92 169.42 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 96.5 p -147.21 -179.86 7.13 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.813 1.188 . . . . 0.0 113.188 -170.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -19.18 -71.3 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 128.922 2.889 . . . . 0.0 115.132 -178.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.1 ttpt -60.38 -44.76 95.34 Favored 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 121.88 -0.512 . . . . 0.0 109.879 -172.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -59.97 -40.98 90.95 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 123.199 0.6 . . . . 0.0 110.084 177.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 38.0 mt -65.2 -49.99 67.61 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 118.121 0.419 . . . . 0.0 111.365 178.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -57.6 -51.25 70.25 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 178.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 59.1 tt0 -48.4 -57.75 5.6 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.988 1.315 . . . . 0.0 109.751 173.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.3 mt -46.36 -72.94 0.05 OUTLIER 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 124.306 1.043 . . . . 0.0 110.247 176.017 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 18.8 tt -55.54 -42.53 68.75 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 CA-C-N 117.787 0.267 . . . . 0.0 110.533 -169.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -56.38 -51.37 68.58 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.83 -0.544 . . . . 0.0 111.618 174.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.29 -54.07 24.1 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 118.12 0.418 . . . . 0.0 110.596 -174.04 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.14 -9.12 43.61 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -169.771 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 23.1 mt . . . . . 0 N--CA 1.456 -0.158 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 170.801 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 . . . . . 0 N--CA 1.465 0.298 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -32.62 -62.01 0.25 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.535 1.534 . . . . 0.0 114.563 -174.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -65.23 -36.0 82.79 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-O 120.796 0.331 . . . . 0.0 111.093 -174.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.401 ' N ' ' CD1' ' A' ' 53' ' ' ILE . 1.3 mp -66.59 -52.75 42.55 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 N-CA-C 105.941 -1.874 . . . . 0.0 105.941 -176.267 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 86.4 t -53.38 -45.01 56.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 C-N-CA 124.173 0.989 . . . . 0.0 109.922 174.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.1 -50.39 73.65 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 118.92 0.782 . . . . 0.0 111.444 176.181 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 54.9 mt -56.06 -39.87 72.7 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 119.151 -0.452 . . . . 0.0 111.038 178.037 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 24.7 mmt -67.49 -60.35 2.64 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.808 0.731 . . . . 0.0 109.457 175.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -46.83 -40.17 13.31 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 126.89 2.076 . . . . 0.0 111.697 -176.23 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -38.78 -48.98 1.58 Allowed 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 124.908 1.283 . . . . 0.0 111.842 174.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 73.1 mt -58.45 -54.23 49.41 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.792 -0.448 . . . . 0.0 109.792 -176.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -66.01 -40.15 90.86 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 124.092 0.957 . . . . 0.0 111.275 -178.029 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 17.4 ttm180 . . . . . 0 N--CA 1.451 -0.375 0 C-N-CA 123.895 0.878 . . . . 0.0 109.585 178.254 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 . . . . . 0 N--CA 1.452 -0.327 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 11.0 m -80.37 139.79 17.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 -179.047 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -83.17 172.09 13.0 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 120.988 0.423 . . . . 0.0 111.232 176.385 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -41.61 -59.48 1.62 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.577 1.151 . . . . 0.0 111.827 173.08 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 36.0 tp60 -61.12 -38.87 87.89 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 119.11 0.868 . . . . 0.0 111.564 -175.6 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -60.94 -44.6 97.02 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.532 -0.73 . . . . 0.0 110.807 174.347 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -58.08 -47.62 82.65 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 121.699 -0.626 . . . . 0.0 109.961 174.115 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.7 mm -59.08 -33.51 50.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 O-C-N 121.704 -0.622 . . . . 0.0 110.174 175.315 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 41.8 m -69.24 -36.2 76.92 Favored 'General case' 0 C--O 1.224 -0.287 0 O-C-N 121.448 -0.782 . . . . 0.0 110.402 173.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -58.52 -56.88 16.4 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 173.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 33.1 mt -60.7 -45.2 95.09 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 122.451 0.3 . . . . 0.0 111.781 178.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.65 -43.97 95.64 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.742 -0.943 . . . . 0.0 110.742 -176.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.02 -45.48 81.36 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 121.961 -0.729 . . . . 0.0 110.139 176.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -48.73 -55.71 10.66 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.469 0.708 . . . . 0.0 109.872 171.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -53.37 -54.8 31.4 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 124.28 1.032 . . . . 0.0 111.092 178.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 21.7 ttp -63.02 -36.26 82.97 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 123.995 0.918 . . . . 0.0 111.774 -176.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 83.1 mt -64.31 -60.66 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 176.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.439 0.2 OUTLIER -67.79 -35.7 79.11 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 117.188 -1.805 . . . . 0.0 112.638 -173.374 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 44.6 m-80 -80.1 65.8 5.37 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 169.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -35.38 -46.94 0.4 Allowed 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 126.413 1.885 . . . . 0.0 111.968 -176.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -27.64 -58.25 0.11 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.711 2.004 . . . . 0.0 113.307 171.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.7 mt . . . . . 0 CA--C 1.533 0.323 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -172.243 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.216 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 46.1 p -69.66 166.7 28.85 Favored Pre-proline 0 N--CA 1.452 -0.366 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 171.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_exo -49.37 -44.95 32.43 Favored 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 122.438 2.092 . . . . 0.0 110.986 168.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 2.1 mt -56.28 -58.36 8.3 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 118.621 -0.704 . . . . 0.0 112.475 170.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -56.61 -38.8 72.56 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 119.162 0.892 . . . . 0.0 110.481 -174.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 -61.4 -51.47 68.61 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.952 0.901 . . . . 0.0 111.194 173.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.73 -46.2 90.66 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.631 0.729 . . . . 0.0 111.362 -178.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 82.4 mt -53.03 -52.1 32.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 C-N-CA 124.597 1.159 . . . . 0.0 108.048 169.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.53 -47.66 22.93 Favored Glycine 0 CA--C 1.527 0.818 0 C-N-CA 124.94 1.257 . . . . 0.0 111.903 174.211 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.6 mt -54.48 -56.47 18.42 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.719 0.808 . . . . 0.0 110.408 173.292 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -56.79 -43.31 80.77 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 118.663 0.665 . . . . 0.0 111.69 -179.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 99.3 mt -58.42 -54.41 33.26 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 C-N-CA 123.007 0.523 . . . . 0.0 110.681 173.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.76 -49.93 67.08 Favored Glycine 0 CA--C 1.522 0.519 0 N-CA-C 110.313 -1.115 . . . . 0.0 110.313 -177.156 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 8.1 mm -51.25 -51.66 22.23 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 C-N-CA 124.182 0.993 . . . . 0.0 109.843 173.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -54.17 -56.44 18.21 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 110.172 -0.306 . . . . 0.0 110.172 177.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -58.04 -38.15 75.7 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 123.754 0.821 . . . . 0.0 111.241 -175.236 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 64.2 tttm -50.37 -42.82 53.92 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.824 0.849 . . . . 0.0 111.118 179.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -98.32 -30.42 12.6 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 122.781 0.432 . . . . 0.0 112.029 -178.365 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 14.2 m . . . . . 0 C--O 1.226 -0.133 0 O-C-N 121.861 -0.524 . . . . 0.0 110.925 178.92 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 14.7 m80 . . . . . 0 CA--C 1.537 0.454 0 N-CA-C 110.232 -0.285 . . . . 0.0 110.232 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 53.8 p -134.06 166.97 21.49 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 125.298 1.439 . . . . 0.0 107.522 169.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -160.77 160.25 31.05 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 171.55 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -100.93 176.74 5.17 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.42 1.488 . . . . 0.0 113.009 -169.589 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -42.72 -52.17 5.04 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 126.533 1.933 . . . . 0.0 113.825 179.13 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -62.81 -47.63 82.62 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 -175.22 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -59.29 -40.56 86.57 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.701 0.8 . . . . 0.0 111.187 177.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 35.5 mt -64.44 -48.1 76.58 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 118.471 0.578 . . . . 0.0 111.311 175.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 9.0 mtmp? -57.86 -43.24 85.83 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.951 -0.468 . . . . 0.0 110.297 175.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -55.28 -57.91 9.88 Favored 'General case' 0 C--O 1.224 -0.245 0 CA-C-O 119.189 -0.434 . . . . 0.0 110.553 171.076 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 10.7 mt -44.22 -59.39 2.38 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 123.898 0.879 . . . . 0.0 110.242 -179.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 16.0 tt -64.64 -51.43 67.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 C-N-CA 119.683 -0.807 . . . . 0.0 110.297 -177.47 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.24 -32.59 74.24 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 120.959 -1.088 . . . . 0.0 112.887 -172.42 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.11 -58.5 2.54 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.194 0.998 . . . . 0.0 109.937 177.611 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 49.7 mm-40 -82.78 -24.79 33.27 Favored 'General case' 0 CA--C 1.529 0.171 0 O-C-N 121.449 -0.782 . . . . 0.0 112.966 -168.395 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 58.4 mt . . . . . 0 N--CA 1.46 0.065 0 C-N-CA 124.958 1.303 . . . . 0.0 108.02 169.593 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 . . . . . 0 CA--C 1.528 0.13 0 N-CA-C 114.777 1.399 . . . . 0.0 114.777 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.4 -60.08 0.15 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.682 1.593 . . . . 0.0 114.45 -176.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 62.3 tt0 -63.55 -44.06 95.26 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 122.756 0.422 . . . . 0.0 110.81 -176.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.2 mp -59.96 -50.06 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.459 0 N-CA-C 106.461 -1.681 . . . . 0.0 106.461 -176.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 75.0 t -55.96 -54.62 24.84 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.535 176.528 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.41 -51.04 28.56 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 118.555 0.616 . . . . 0.0 111.764 -179.641 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 27.7 mt -52.19 -40.86 62.11 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 122.703 0.401 . . . . 0.0 112.06 -178.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -81.06 -58.48 3.05 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.625 0.77 . . . . 0.0 110.582 179.751 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -40.98 -42.61 1.93 Allowed 'General case' 0 N--CA 1.462 0.133 0 C-N-CA 126.484 1.914 . . . . 0.0 111.418 177.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -38.41 -51.64 1.55 Allowed 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 125.123 1.369 . . . . 0.0 112.897 174.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -58.15 -50.54 73.15 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -174.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -64.49 -49.04 72.92 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.683 0.393 . . . . 0.0 110.445 179.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 13.7 ttm180 -50.99 -54.2 26.49 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 124.113 0.965 . . . . 0.0 110.073 -179.154 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 13.3 m120 . . . . . 0 N--CA 1.453 -0.319 0 CA-C-O 119.135 -0.46 . . . . 0.0 110.638 -179.513 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 . . . . . 0 N--CA 1.453 -0.291 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 19.7 m -79.06 145.8 8.91 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.225 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 -177.328 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -82.77 177.7 8.54 Favored 'General case' 0 CA--C 1.528 0.133 0 C-N-CA 123.925 0.89 . . . . 0.0 111.377 177.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -48.16 -63.31 1.11 Allowed 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 123.963 0.905 . . . . 0.0 112.209 178.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 43.2 tp60 -61.99 -34.18 75.69 Favored 'General case' 0 CA--C 1.531 0.245 0 O-C-N 121.138 -0.976 . . . . 0.0 111.13 -174.03 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 61.3 mt-10 -63.24 -45.54 91.11 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 121.569 -0.707 . . . . 0.0 110.75 174.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -54.61 -49.11 71.24 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 121.645 -0.659 . . . . 0.0 109.98 170.799 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 22.4 mm -57.94 -34.47 48.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 O-C-N 121.689 -0.632 . . . . 0.0 110.343 176.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 33.2 m -67.9 -39.74 83.57 Favored 'General case' 0 CA--C 1.53 0.206 0 O-C-N 121.343 -0.848 . . . . 0.0 110.541 175.425 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -53.8 -55.19 28.7 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.656 -0.652 . . . . 0.0 109.63 171.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 34.9 mt -60.16 -45.32 93.46 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.791 178.707 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.0 -42.25 98.29 Favored Glycine 0 CA--C 1.524 0.623 0 N-CA-C 110.787 -0.925 . . . . 0.0 110.787 -176.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.43 -50.17 68.59 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 123.273 0.629 . . . . 0.0 110.108 175.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -48.14 -56.66 7.3 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 121.775 0.798 . . . . 0.0 110.136 173.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.81 -54.1 39.01 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.015 1.326 . . . . 0.0 110.695 179.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 50.1 ttm -57.32 -48.67 78.37 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.232 1.013 . . . . 0.0 110.619 -179.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 61.9 mt -63.36 -51.43 71.01 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-O 117.585 -1.198 . . . . 0.0 109.653 -174.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.436 0.8 OUTLIER -73.58 -39.69 64.46 Favored 'General case' 0 C--N 1.347 0.482 0 C-N-CA 118.15 -1.42 . . . . 0.0 112.707 -179.561 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -80.59 63.09 4.9 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 169.06 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -51.33 -25.22 5.58 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.102 0.961 . . . . 0.0 113.058 -172.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -39.55 -50.51 2.2 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.832 1.253 . . . . 0.0 111.49 167.107 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 86.1 mt . . . . . 0 CA--C 1.53 0.211 0 C-N-CA 124.689 1.196 . . . . 0.0 113.535 -176.748 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.198 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 70.0 p -54.4 162.93 1.44 Allowed Pre-proline 0 CA--C 1.533 0.319 0 C-N-CA 124.348 1.059 . . . . 0.0 111.21 174.03 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -47.99 -46.59 21.55 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.356 2.038 . . . . 0.0 110.676 168.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.7 mt -55.11 -59.28 4.98 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-O 119.26 -0.4 . . . . 0.0 111.716 173.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -52.55 -48.14 66.32 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.13 0.423 . . . . 0.0 110.336 -176.021 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.85 -49.98 75.27 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.499 0.72 . . . . 0.0 110.258 -179.558 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.49 -45.69 91.87 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.949 0.9 . . . . 0.0 111.99 -177.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 84.8 mt -55.14 -50.92 59.91 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 N-CA-C 107.737 -1.209 . . . . 0.0 107.737 171.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -45.56 -49.14 11.92 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 124.505 1.05 . . . . 0.0 112.033 172.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.6 mt -56.88 -55.15 38.16 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.055 0.927 . . . . 0.0 111.303 175.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -59.85 -44.42 94.13 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 119.293 0.951 . . . . 0.0 111.505 -177.491 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 77.8 mt -56.45 -53.71 37.25 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 123.523 0.729 . . . . 0.0 109.948 173.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -53.81 -49.29 58.9 Favored Glycine 0 CA--C 1.522 0.47 0 C-N-CA 124.443 1.021 . . . . 0.0 110.572 -179.124 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 7.3 mm -57.76 -44.53 86.1 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 C-N-CA 122.986 0.514 . . . . 0.0 110.185 176.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 39.6 t80 -55.81 -54.89 39.0 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 118.797 0.726 . . . . 0.0 109.89 175.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 37.4 m-70 -64.9 -26.78 68.46 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 113.48 0.918 . . . . 0.0 113.48 -177.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.2 ttmm -52.82 -26.11 13.53 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 118.694 0.679 . . . . 0.0 110.751 170.403 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -127.51 41.7 3.46 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.715 1.206 . . . . 0.0 109.118 173.174 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 31.9 m . . . . . 0 C--N 1.348 0.512 0 C-N-CA 125.799 1.64 . . . . 0.0 112.408 -177.557 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 22.8 p . . . . . 0 CA--C 1.532 0.272 0 N-CA-C 113.256 0.835 . . . . 0.0 113.256 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -137.44 158.76 43.71 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.543 1.137 . . . . 0.0 110.77 176.824 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 88.8 p -117.71 -173.91 2.52 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.395 1.078 . . . . 0.0 112.8 -169.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 49.4 pttt -41.47 -54.53 3.09 Favored 'General case' 0 C--N 1.34 0.194 0 C-N-CA 126.144 1.778 . . . . 0.0 113.77 -177.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.84 -52.83 59.16 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 124.66 1.184 . . . . 0.0 108.457 -177.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -64.33 -38.59 91.57 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 123.723 0.809 . . . . 0.0 110.689 -177.441 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -60.95 -54.91 39.22 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 118.869 0.758 . . . . 0.0 111.299 175.245 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 53.4 mtmt -56.54 -48.53 77.06 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.067 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 62.9 tt0 -50.46 -59.0 4.45 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.174 0.989 . . . . 0.0 110.427 175.206 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mt -47.1 -65.87 0.5 Allowed 'General case' 0 C--O 1.232 0.165 0 C-N-CA 124.968 1.307 . . . . 0.0 110.411 177.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 16.7 tt -62.42 -45.7 98.17 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 C-N-CA 120.04 -0.664 . . . . 0.0 109.77 -170.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -58.72 -51.79 68.46 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 122.836 0.454 . . . . 0.0 111.404 -179.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -66.26 -57.66 7.06 Favored 'General case' 0 C--N 1.339 0.11 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 -177.517 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -71.96 -61.63 1.72 Allowed 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 -169.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 54.7 mt . . . . . 0 N--CA 1.451 -0.382 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.447 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 . . . . . 0 C--O 1.226 -0.14 0 N-CA-C 110.405 -0.22 . . . . 0.0 110.405 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -38.03 -58.18 0.97 Allowed 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.648 1.179 . . . . 0.0 113.548 -171.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -64.21 -38.36 90.78 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 122.751 0.42 . . . . 0.0 111.196 -175.071 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -62.13 -54.12 38.61 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 N-CA-C 106.397 -1.705 . . . . 0.0 106.397 179.206 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 87.5 t -57.4 -42.09 79.88 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 C-N-CA 124.173 0.989 . . . . 0.0 110.566 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.05 -50.59 73.13 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 119.384 0.993 . . . . 0.0 110.886 175.13 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 42.1 mt -54.21 -45.19 72.18 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 119.396 -0.335 . . . . 0.0 110.681 177.168 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 23.2 mmt -64.94 -60.69 2.77 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 121.403 0.621 . . . . 0.0 109.499 177.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -42.7 -42.93 3.68 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 126.815 2.046 . . . . 0.0 111.521 -178.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -45.7 -45.37 14.22 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 118.517 -0.754 . . . . 0.0 112.97 178.19 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . 0.259 0.5 OUTLIER -72.04 -11.49 60.78 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 119.805 1.184 . . . . 0.0 113.209 -176.838 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -90.68 -53.89 4.22 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 118.983 0.81 . . . . 0.0 109.206 169.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 55.3 ttm-85 . . . . . 0 CA--C 1.532 0.276 0 C-N-CA 123.986 0.914 . . . . 0.0 110.693 179.552 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.9 mp0 . . . . . 0 N--CA 1.448 -0.56 0 N-CA-C 106.241 -1.763 . . . . 0.0 106.241 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -96.96 151.16 4.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 C-N-CA 124.266 1.026 . . . . 0.0 108.467 172.442 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -92.94 177.12 6.18 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 122.834 0.454 . . . . 0.0 111.287 176.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 79.6 t80 -41.14 -62.43 0.84 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.315 1.046 . . . . 0.0 112.034 171.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 39.8 tp60 -60.64 -37.42 81.43 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 119.24 0.927 . . . . 0.0 111.623 -174.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -61.47 -44.68 96.67 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 119.28 0.946 . . . . 0.0 111.424 173.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -53.94 -50.03 67.38 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 118.742 0.701 . . . . 0.0 109.726 172.581 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.401 ' CG2' ' CG2' ' B' ' 74' ' ' ILE . 28.1 mm -57.96 -38.27 65.7 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 O-C-N 121.901 -0.499 . . . . 0.0 110.518 176.024 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 61.3 m -64.88 -42.39 94.85 Favored 'General case' 0 C--O 1.226 -0.134 0 CA-C-N 118.824 0.738 . . . . 0.0 110.234 177.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 33.0 t80 -55.55 -52.69 62.88 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.429 0.691 . . . . 0.0 109.213 174.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 62.3 mt -60.66 -44.69 96.14 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 177.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.13 -44.41 94.12 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 110.623 -0.991 . . . . 0.0 110.623 -176.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.85 -52.13 66.74 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.252 0.621 . . . . 0.0 109.824 174.718 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 11.7 tp -47.78 -58.15 4.7 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 122.002 0.906 . . . . 0.0 110.381 175.228 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -49.67 -55.47 13.65 Favored 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 125.43 1.492 . . . . 0.0 109.857 -179.327 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 12.9 ttp -60.53 -44.31 96.19 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 123.364 0.666 . . . . 0.0 111.507 -178.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 51.7 mt -59.19 -54.61 31.9 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-O 118.258 -0.877 . . . . 0.0 110.049 -178.36 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.391 0.6 OUTLIER -76.0 -34.22 59.71 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 118.188 -1.405 . . . . 0.0 112.964 -179.08 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 37.0 m-80 -80.33 71.06 7.11 Favored 'General case' 0 N--CA 1.465 0.276 0 O-C-N 120.654 -1.279 . . . . 0.0 108.747 170.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -46.55 -31.5 2.82 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.554 1.142 . . . . 0.0 112.798 -178.124 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -42.47 -37.75 1.71 Allowed 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.044 1.338 . . . . 0.0 113.729 173.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 88.4 mt . . . . . 0 CA--C 1.534 0.328 0 N-CA-C 112.949 0.722 . . . . 0.0 112.949 -177.61 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.249 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 9.6 m -54.14 160.57 2.31 Favored Pre-proline 0 CA--C 1.538 0.509 0 C-N-CA 123.309 0.643 . . . . 0.0 110.851 175.172 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_exo -42.16 -49.56 5.86 Favored 'Trans proline' 0 N--CA 1.459 -0.52 0 C-N-CA 123.775 2.983 . . . . 0.0 113.661 177.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 6.1 mt -54.52 -50.52 67.67 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-N 117.956 0.344 . . . . 0.0 111.54 173.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -63.49 -40.9 98.31 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 118.211 0.459 . . . . 0.0 110.196 -175.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 tp60 -61.89 -47.07 86.64 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 122.142 0.177 . . . . 0.0 110.694 174.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.05 -46.88 85.45 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.465 0.706 . . . . 0.0 111.02 -178.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 62.1 mt -51.4 -54.4 11.91 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 N-CA-C 107.948 -1.131 . . . . 0.0 107.948 169.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.07 -46.88 20.57 Favored Glycine 0 CA--C 1.528 0.859 0 C-N-CA 124.906 1.241 . . . . 0.0 112.183 175.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.2 mt -57.38 -54.21 49.37 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 117.59 0.695 . . . . 0.0 111.055 174.489 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -58.52 -44.07 89.37 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 118.863 0.756 . . . . 0.0 111.481 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 72.2 mt -54.38 -55.73 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 C-N-CA 123.462 0.705 . . . . 0.0 110.077 172.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.28 -51.38 51.36 Favored Glycine 0 CA--C 1.524 0.633 0 N-CA-C 110.234 -1.146 . . . . 0.0 110.234 -176.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 14.1 mm -54.5 -45.83 70.84 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 C-N-CA 122.79 0.436 . . . . 0.0 110.499 175.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -57.12 -60.19 3.98 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 118.465 0.575 . . . . 0.0 109.997 176.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -55.34 -36.46 66.31 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 124.424 1.09 . . . . 0.0 111.511 -174.181 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -52.59 -31.06 34.4 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.566 1.146 . . . . 0.0 112.257 176.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -112.59 -34.08 5.94 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.764 0.711 . . . . 0.0 112.076 -179.315 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 77.8 p . . . . . 0 N--CA 1.455 -0.182 0 CA-C-N 119.135 0.88 . . . . 0.0 110.866 179.582 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 . . . . . 0 CA--C 1.537 0.457 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 22.9 p -129.87 164.25 24.56 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 124.836 1.255 . . . . 0.0 111.419 -177.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -159.56 169.07 24.62 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.626 1.17 . . . . 0.0 109.364 169.716 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 78.5 p -115.94 174.16 6.18 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 -169.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 38.1 mtmm -26.35 -60.3 0.08 Allowed 'General case' 0 C--N 1.34 0.171 0 C-N-CA 127.764 2.426 . . . . 0.0 112.597 169.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 28.8 ttpp -53.37 -53.23 54.18 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.885 0.874 . . . . 0.0 110.748 -177.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -61.36 -40.44 94.31 Favored 'General case' 0 C--O 1.222 -0.344 0 CA-C-O 118.967 -0.54 . . . . 0.0 110.595 179.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 31.1 mt -64.49 -48.05 76.65 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.934 0.788 . . . . 0.0 111.179 -179.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -58.12 -47.93 81.77 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 176.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.63 -51.14 69.85 Favored 'General case' 0 C--O 1.225 -0.216 0 CA-C-N 117.762 0.255 . . . . 0.0 111.242 174.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 11.5 mt -48.18 -57.51 5.8 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 124.25 1.02 . . . . 0.0 109.77 179.07 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 1.3 mp -56.84 -59.1 3.42 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 C-N-CA 120.18 -0.608 . . . . 0.0 109.831 175.179 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -51.33 -46.8 62.75 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.358 0.663 . . . . 0.0 112.372 -171.183 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.71 -64.54 1.16 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.709 0.804 . . . . 0.0 110.08 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -73.87 -24.84 59.8 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -167.177 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 96.3 mt . . . . . 0 C--N 1.333 -0.12 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 169.287 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 21.0 t70 . . . . . 0 N--CA 1.462 0.172 0 N-CA-C 111.927 0.343 . . . . 0.0 111.927 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -34.77 -60.99 0.42 Allowed 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.905 1.282 . . . . 0.0 113.72 -176.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -66.23 -33.97 76.96 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.588 0.355 . . . . 0.0 111.365 -174.469 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -62.89 -55.73 21.87 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 178.665 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 55.8 t -57.66 -43.82 84.3 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 CA-C-O 118.755 -0.64 . . . . 0.0 110.599 179.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.48 -51.06 69.87 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 119.233 0.924 . . . . 0.0 110.562 176.492 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 55.2 mt -56.63 -40.58 75.63 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 119.058 -0.496 . . . . 0.0 111.405 178.751 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 28.3 mmt -67.25 -65.04 0.74 Allowed 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.919 0.781 . . . . 0.0 109.453 175.531 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -40.58 -41.93 1.57 Allowed 'General case' 0 CA--C 1.521 -0.155 0 C-N-CA 128.022 2.529 . . . . 0.0 111.939 -177.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -37.73 -49.17 1.13 Allowed 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 124.93 1.292 . . . . 0.0 112.287 176.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.6 pp -61.18 -42.91 99.41 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 120.958 -0.297 . . . . 0.0 111.085 -176.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -73.98 -38.3 64.19 Favored 'General case' 0 C--O 1.226 -0.173 0 C-N-CA 123.155 0.582 . . . . 0.0 110.407 -179.175 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 15.8 ttm180 -59.46 -47.98 83.39 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.164 0.586 . . . . 0.0 109.951 177.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 . . . . . 0 N--CA 1.457 -0.094 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.264 -175.52 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 40.6 mp0 . . . . . 0 N--CA 1.451 -0.388 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 11.7 m -80.07 145.25 9.46 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 171.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -82.89 172.21 13.06 Favored 'General case' 0 CA--C 1.528 0.107 0 CA-C-N 117.961 0.346 . . . . 0.0 111.193 176.282 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -40.86 -61.61 0.94 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.185 0.994 . . . . 0.0 112.146 172.161 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 38.2 tp60 -60.33 -37.04 79.36 Favored 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.224 -0.922 . . . . 0.0 111.795 -175.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -64.93 -40.82 95.62 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 121.284 -0.885 . . . . 0.0 111.488 174.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -56.43 -49.72 73.74 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.571 -0.706 . . . . 0.0 109.622 170.535 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.401 ' CG2' ' CG2' ' A' ' 74' ' ' ILE . 29.0 mm -56.24 -39.56 60.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 175.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 43.1 m -65.69 -35.74 81.63 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 118.59 0.632 . . . . 0.0 110.679 176.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 13.1 t80 -56.02 -56.25 23.06 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 171.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 67.7 mt -61.25 -40.13 92.91 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 179.089 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -69.05 -45.6 61.92 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 110.675 -0.97 . . . . 0.0 110.675 -176.134 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.29 -43.82 89.92 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 122.112 -0.64 . . . . 0.0 110.058 175.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 12.0 tp -50.56 -57.58 7.82 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-O 121.371 0.605 . . . . 0.0 109.939 172.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.19 -50.86 48.04 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 124.441 1.096 . . . . 0.0 110.527 176.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 49.2 ttm -58.33 -47.75 82.74 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.715 0.806 . . . . 0.0 111.135 -178.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 93.9 mt -64.65 -52.72 51.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 CA-C-O 118.135 -0.936 . . . . 0.0 110.398 -176.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.449 0.1 OUTLIER -76.2 -38.86 55.96 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 118.521 -1.271 . . . . 0.0 113.3 -176.672 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -82.13 66.99 7.96 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 169.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -39.44 -37.8 0.5 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.818 1.647 . . . . 0.0 113.842 -175.188 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.99 -53.98 0.47 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.004 1.722 . . . . 0.0 112.502 169.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 93.2 mt . . . . . 0 C--O 1.224 -0.267 0 C-N-CA 123.81 0.844 . . . . 0.0 113.081 -174.039 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.257 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.1 m -55.56 163.09 2.04 Favored Pre-proline 0 CA--C 1.537 0.452 0 C-N-CA 124.102 0.961 . . . . 0.0 110.846 178.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -43.85 -49.02 8.57 Favored 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 123.62 2.88 . . . . 0.0 113.409 179.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.2 mt -55.14 -52.13 64.25 Favored 'General case' 0 C--O 1.225 -0.218 0 O-C-N 122.369 -0.207 . . . . 0.0 111.512 174.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -61.56 -41.98 98.18 Favored 'General case' 0 C--O 1.226 -0.181 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 -175.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 12.6 tp-100 -60.31 -51.25 70.33 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 123.4 0.68 . . . . 0.0 110.203 177.157 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.14 -46.15 88.58 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.291 0.636 . . . . 0.0 111.442 -177.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 56.4 mt -53.07 -51.43 38.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 170.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -48.61 -48.03 29.18 Favored Glycine 0 CA--C 1.525 0.688 0 C-N-CA 125.14 1.352 . . . . 0.0 111.587 175.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 mt -56.54 -54.03 50.6 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 117.652 0.726 . . . . 0.0 111.055 174.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 mp -58.81 -43.71 90.64 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 119.032 0.833 . . . . 0.0 111.453 -179.404 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 94.2 mt -56.52 -51.66 62.58 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 C-N-CA 123.632 0.773 . . . . 0.0 110.36 172.641 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.23 -51.58 53.19 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.046 -1.222 . . . . 0.0 110.046 -178.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 10.4 mm -57.01 -46.29 84.08 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 123.158 0.583 . . . . 0.0 110.284 176.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 40.6 t80 -53.2 -59.16 4.9 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 121.211 0.529 . . . . 0.0 109.965 176.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 67.4 t60 -62.09 -33.75 75.02 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.706 -175.682 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -51.96 -45.61 64.46 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.69 0.677 . . . . 0.0 110.963 176.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -89.86 -49.55 6.56 Favored 'General case' 0 N--CA 1.46 0.037 0 CA-C-O 118.932 -0.556 . . . . 0.0 110.946 -178.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 74.8 m . . . . . 0 C--O 1.224 -0.248 0 CA-C-N 119.166 0.894 . . . . 0.0 111.384 174.652 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.228 0 N-CA-C 103.192 -2.892 . . . . 0.0 103.192 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -160.74 168.04 25.62 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 120.158 1.345 . . . . 0.0 112.253 177.555 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 24.7 p -113.19 176.46 5.01 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.617 0.723 . . . . 0.0 112.503 -173.42 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 20.7 pttm -40.62 -46.94 2.66 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 126.051 1.74 . . . . 0.0 112.846 174.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.0 tmmt? -59.08 -49.7 76.89 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -178.083 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 27.2 mp0 -62.98 -38.62 91.88 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 118.756 -0.64 . . . . 0.0 110.963 177.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 26.1 mt -62.43 -45.01 95.05 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 119.319 0.963 . . . . 0.0 111.182 178.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -58.3 -49.47 77.03 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 122.025 -0.422 . . . . 0.0 109.978 173.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 57.6 mt-10 -56.47 -43.82 79.97 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 118.03 0.377 . . . . 0.0 111.449 175.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.0 mt -54.32 -56.3 19.84 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 119.296 0.953 . . . . 0.0 109.492 -178.432 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 1.3 mp -55.96 -60.7 1.55 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 175.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.8 tt0 -52.31 -51.42 58.74 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.649 0.78 . . . . 0.0 112.383 -171.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.1 mmpt? -73.4 -61.12 1.94 Allowed 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.987 1.315 . . . . 0.0 109.307 -175.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 60.5 mm-40 -76.71 -58.01 3.53 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -169.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 85.1 mt . . . . . 0 N--CA 1.454 -0.264 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 178.868 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 . . . . . 0 N--CA 1.462 0.153 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.46 -58.27 0.16 Allowed 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 126.08 1.752 . . . . 0.0 113.839 -177.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -70.08 -35.88 74.51 Favored 'General case' 0 CA--C 1.53 0.191 0 O-C-N 122.258 -0.276 . . . . 0.0 111.466 -173.23 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 1.2 mp -62.72 -54.71 30.27 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 177.064 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 72.5 t -54.21 -44.45 64.67 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 C-N-CA 124.458 1.103 . . . . 0.0 110.034 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 2.9 mptp? -57.52 -53.17 61.23 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 118.283 0.492 . . . . 0.0 110.793 175.337 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 71.2 mt -54.83 -37.81 66.61 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 118.965 -0.54 . . . . 0.0 111.198 178.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 27.8 mmt -66.95 -67.61 0.44 Allowed 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 118.809 0.732 . . . . 0.0 109.525 173.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -40.48 -42.62 1.66 Allowed 'General case' 0 C--N 1.341 0.199 0 C-N-CA 127.527 2.331 . . . . 0.0 111.95 -176.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -38.7 -49.64 1.59 Allowed 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 125.261 1.424 . . . . 0.0 112.492 177.095 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -63.24 -42.0 99.14 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 121.032 -0.267 . . . . 0.0 110.715 -176.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -69.52 -42.17 75.04 Favored 'General case' 0 N--CA 1.457 -0.084 0 C-N-CA 123.538 0.735 . . . . 0.0 109.602 -178.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 17.5 ttm180 . . . . . 0 N--CA 1.451 -0.405 0 C-N-CA 124.25 1.02 . . . . 0.0 110.143 178.647 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 22.5 mp0 . . . . . 0 CA--C 1.534 0.331 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 25.8 m -115.05 149.11 17.36 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.558 0 C-N-CA 125.917 1.687 . . . . 0.0 107.758 169.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -85.8 175.57 8.6 Favored 'General case' 0 C--N 1.338 0.102 0 C-N-CA 123.68 0.792 . . . . 0.0 111.015 177.454 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -41.91 -63.8 0.68 Allowed 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.806 1.242 . . . . 0.0 112.436 175.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 9.9 tp-100 -64.5 -30.45 71.48 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 120.339 1.427 . . . . 0.0 112.019 -173.276 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -66.84 -45.53 77.94 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 119.35 0.977 . . . . 0.0 110.348 175.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -54.72 -52.27 62.99 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 172.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 22.8 mm -55.32 -41.41 61.58 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.411 0 C-N-CA 123.102 0.561 . . . . 0.0 109.519 176.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 99.4 m -62.39 -36.04 81.08 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-N 119.089 0.859 . . . . 0.0 111.062 177.088 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -54.89 -54.57 40.8 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 118.887 0.767 . . . . 0.0 109.185 171.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 62.3 mt -63.63 -40.86 97.97 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 -179.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -72.83 -44.29 38.58 Favored Glycine 0 CA--C 1.522 0.522 0 N-CA-C 110.128 -1.189 . . . . 0.0 110.128 -174.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.43 -45.11 92.44 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 121.949 -0.736 . . . . 0.0 109.795 173.255 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 12.4 tp -49.81 -58.14 5.96 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 118.802 0.728 . . . . 0.0 109.909 173.133 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -49.34 -54.03 19.19 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 124.804 1.242 . . . . 0.0 110.606 178.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 25.4 ttp -64.11 -41.54 97.21 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.252 0.621 . . . . 0.0 112.068 -176.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 80.0 mt -65.12 -51.56 64.29 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 CA-C-O 118.042 -0.98 . . . . 0.0 109.746 -178.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.46 0.1 OUTLIER -75.76 -39.3 57.34 Favored 'General case' 0 C--N 1.346 0.436 0 CA-C-N 119.713 1.142 . . . . 0.0 113.283 -178.544 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 -81.07 65.01 6.05 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 168.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -47.91 -32.86 6.8 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.94 1.296 . . . . 0.0 112.4 -169.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -32.54 -50.55 0.25 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 126.104 1.762 . . . . 0.0 112.773 168.355 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 63.2 mt . . . . . 0 CA--C 1.53 0.21 0 C-N-CA 124.015 0.926 . . . . 0.0 113.322 -174.864 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.242 0 CA-C-O 121.191 0.519 . . . . 0.0 110.053 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 4.2 m -58.1 165.17 2.84 Favored Pre-proline 0 CA--C 1.538 0.513 0 C-N-CA 124.961 1.305 . . . . 0.0 111.365 179.193 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -44.47 -46.77 11.71 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 123.503 2.802 . . . . 0.0 113.306 177.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.7 mt -56.16 -51.48 67.82 Favored 'General case' 0 C--O 1.225 -0.229 0 CA-C-N 117.844 0.293 . . . . 0.0 111.577 174.123 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -57.83 -45.57 85.97 Favored 'General case' 0 N--CA 1.456 -0.159 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 -177.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -58.73 -51.57 69.41 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 122.932 0.493 . . . . 0.0 110.727 177.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.32 -45.41 88.0 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.719 0.807 . . . . 0.0 111.668 -176.158 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 78.7 mt -54.13 -52.38 38.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 170.475 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.15 -48.36 15.08 Favored Glycine 0 CA--C 1.528 0.855 0 C-N-CA 124.867 1.222 . . . . 0.0 111.946 174.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.3 mt -56.88 -55.85 29.15 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 117.649 0.725 . . . . 0.0 111.27 174.407 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -58.69 -42.38 88.42 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.172 0.897 . . . . 0.0 111.711 -178.445 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 78.7 mt -54.63 -58.97 2.64 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.135 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 171.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -52.29 -48.03 54.69 Favored Glycine 0 CA--C 1.524 0.604 0 C-N-CA 124.726 1.155 . . . . 0.0 111.214 -175.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 12.5 mm -54.63 -46.58 72.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 C-N-CA 123.105 0.562 . . . . 0.0 110.386 176.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 26.2 t80 -61.05 -54.27 46.88 Favored 'General case' 0 CA--C 1.531 0.241 0 O-C-N 121.708 -0.62 . . . . 0.0 109.818 176.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -50.74 -41.72 56.81 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 125.308 1.443 . . . . 0.0 111.435 -176.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -55.58 -34.01 64.41 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.934 1.293 . . . . 0.0 112.407 179.312 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 47.1 m-85 -109.06 -57.45 2.15 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 123.587 0.755 . . . . 0.0 110.896 -176.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.454 -0.237 0 C-N-CA 123.504 0.722 . . . . 0.0 110.244 -177.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 21.9 t-160 . . . . . 0 CA--C 1.535 0.387 0 N-CA-C 111.552 0.204 . . . . 0.0 111.552 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 1.1 p -130.57 158.68 39.33 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 125.107 1.363 . . . . 0.0 112.606 -168.452 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.94 -179.79 7.84 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.055 1.342 . . . . 0.0 108.553 169.423 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 7.3 t -141.6 -163.21 1.52 Allowed 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 119.355 0.98 . . . . 0.0 112.673 -178.127 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 8.6 mtpm? -36.79 -69.12 0.12 Allowed 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 128.716 2.806 . . . . 0.0 113.662 -169.189 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -55.38 -46.97 76.5 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 122.772 0.429 . . . . 0.0 110.068 -173.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -61.32 -44.12 97.74 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 123.797 0.839 . . . . 0.0 110.712 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 51.7 mt -61.31 -52.98 62.43 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 118.341 0.519 . . . . 0.0 111.015 177.072 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 47.9 mtpt -60.92 -42.61 98.46 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -177.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 66.4 mt-10 -54.61 -55.58 28.02 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-O 118.962 -0.542 . . . . 0.0 110.904 169.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 9.1 mt -47.36 -58.89 3.63 Favored 'General case' 0 N--CA 1.457 -0.103 0 C-N-CA 123.406 0.682 . . . . 0.0 110.193 -178.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 13.3 tt -59.34 -55.18 25.39 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 C-N-CA 119.766 -0.774 . . . . 0.0 110.54 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -58.41 -46.05 87.18 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 118.435 0.562 . . . . 0.0 112.438 -172.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -76.76 -51.08 12.07 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.509 0.724 . . . . 0.0 110.093 -177.263 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -83.54 -28.7 28.43 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -168.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 32.7 mt . . . . . 0 C--N 1.338 0.069 0 N-CA-C 106.412 -1.699 . . . . 0.0 106.412 168.483 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 . . . . . 0 C--O 1.227 -0.113 0 N-CA-C 114.397 1.258 . . . . 0.0 114.397 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.58 -61.57 0.14 Allowed 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 125.594 1.558 . . . . 0.0 114.146 -175.217 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -60.31 -43.15 96.62 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.298 0.639 . . . . 0.0 111.333 -175.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -62.16 -51.99 65.79 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 N-CA-C 106.066 -1.827 . . . . 0.0 106.066 -178.785 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 70.7 t -55.3 -40.02 54.74 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.613 0 CA-C-N 114.891 -1.05 . . . . 0.0 110.239 178.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.84 -52.81 63.48 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 120.214 1.37 . . . . 0.0 110.517 174.741 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 57.1 mt -53.52 -39.57 64.74 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 119.573 -0.251 . . . . 0.0 110.683 -178.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 22.9 mmt -71.12 -64.23 0.95 Allowed 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.424 0.63 . . . . 0.0 110.003 175.54 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.01 -29.4 60.29 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 125.041 1.336 . . . . 0.0 112.212 -169.718 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -39.52 -50.69 2.19 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 124.632 1.173 . . . . 0.0 111.037 170.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 54.1 mt -58.82 -47.08 86.07 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.125 -176.421 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -69.73 -46.43 65.93 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.439 0.696 . . . . 0.0 111.283 -178.128 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 50.9 ttt85 -56.84 -52.22 65.94 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 124.972 1.309 . . . . 0.0 109.414 -179.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 20.3 m120 . . . . . 0 N--CA 1.452 -0.371 0 CA-C-N 116.625 -0.261 . . . . 0.0 111.556 -176.121 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 . . . . . 0 N--CA 1.45 -0.433 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 20.9 m -99.89 146.49 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 169.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -85.36 176.02 8.54 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 123.418 0.687 . . . . 0.0 111.271 175.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -40.65 -63.82 0.6 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.306 1.043 . . . . 0.0 112.533 172.421 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 61.6 tp60 -61.03 -36.21 78.92 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 119.755 1.161 . . . . 0.0 111.671 -175.425 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -64.37 -35.84 82.18 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.255 -0.903 . . . . 0.0 111.081 175.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -62.97 -46.8 86.02 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.507 -0.746 . . . . 0.0 109.626 169.361 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 24.2 mm -60.63 -29.19 44.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 O-C-N 121.49 -0.756 . . . . 0.0 110.513 176.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 25.3 m -67.2 -45.13 77.8 Favored 'General case' 0 C--O 1.227 -0.1 0 O-C-N 121.232 -0.917 . . . . 0.0 109.411 171.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -52.32 -54.99 24.51 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 173.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 38.8 mt -59.44 -46.36 88.98 Favored 'General case' 0 CA--C 1.529 0.168 0 O-C-N 121.727 -0.608 . . . . 0.0 111.691 177.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.57 -45.68 92.91 Favored Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 -179.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.97 -51.74 65.71 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 123.493 0.717 . . . . 0.0 110.023 177.281 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -47.36 -58.68 3.87 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.95 0.881 . . . . 0.0 110.272 174.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.08 -56.61 11.73 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 125.18 1.392 . . . . 0.0 110.643 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 12.8 ttp -67.05 -39.15 86.84 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.607 0.763 . . . . 0.0 111.806 -174.372 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 64.5 mt -63.74 -51.76 65.75 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 CA-C-O 117.807 -1.092 . . . . 0.0 109.195 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.474 0.3 OUTLIER -75.25 -38.15 60.67 Favored 'General case' 0 C--N 1.348 0.5 0 CA-C-N 119.897 1.226 . . . . 0.0 113.319 -179.867 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 -80.57 61.88 4.44 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 168.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -52.26 -25.01 8.31 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.532 1.133 . . . . 0.0 112.55 -175.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -38.6 -46.72 1.23 Allowed 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.164 1.385 . . . . 0.0 111.845 167.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 84.4 mt . . . . . 0 CA--C 1.532 0.252 0 C-N-CA 124.12 0.968 . . . . 0.0 113.041 -178.218 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.222 0 CA-C-O 121.252 0.548 . . . . 0.0 111.431 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 78.7 p -60.69 167.4 3.4 Favored Pre-proline 0 CA--C 1.536 0.418 0 C-N-CA 124.414 1.086 . . . . 0.0 112.2 175.479 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -50.57 -44.3 40.84 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 122.619 2.213 . . . . 0.0 111.215 168.245 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.8 mt -53.65 -57.49 10.61 Favored 'General case' 0 C--N 1.342 0.252 0 CA-C-O 119.448 -0.31 . . . . 0.0 111.671 170.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -52.57 -47.65 66.68 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 120.848 0.356 . . . . 0.0 110.356 -177.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 -59.39 -49.41 77.92 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.921 0.888 . . . . 0.0 110.919 178.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.77 -46.63 88.74 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.866 0.866 . . . . 0.0 111.132 -178.084 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 83.1 mt -54.67 -51.41 51.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 172.057 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.72 -50.35 14.78 Favored Glycine 0 CA--C 1.53 0.991 0 C-N-CA 124.562 1.077 . . . . 0.0 111.963 173.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 mt -54.65 -54.37 42.52 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 117.721 0.761 . . . . 0.0 110.936 175.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 9.8 mp -58.71 -43.68 90.17 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 118.79 0.723 . . . . 0.0 111.687 -178.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 97.3 mt -58.59 -52.18 62.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 C-N-CA 123.22 0.608 . . . . 0.0 110.433 174.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.96 -54.55 34.51 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 109.942 -1.263 . . . . 0.0 109.942 -178.325 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 6.0 mm -50.01 -50.11 20.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.25 0 C-N-CA 123.843 0.857 . . . . 0.0 109.911 174.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -52.89 -62.71 1.47 Allowed 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 179.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -63.38 -23.57 67.47 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 -175.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.8 ttpp -53.94 -24.69 17.28 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 118.782 0.719 . . . . 0.0 111.97 170.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -116.95 -37.34 3.61 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.044 0.938 . . . . 0.0 112.792 175.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 75.5 p . . . . . 0 CA--C 1.528 0.125 0 CA-C-N 119.515 1.052 . . . . 0.0 112.164 -178.169 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 74.6 p . . . . . 0 CA--C 1.528 0.097 0 CA-C-O 121.069 0.461 . . . . 0.0 111.318 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -159.69 -165.04 1.44 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.211 1.404 . . . . 0.0 107.44 169.498 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 9.2 m -156.88 -179.5 8.26 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 119.371 0.987 . . . . 0.0 111.633 -171.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -19.72 -72.98 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 129.247 3.019 . . . . 0.0 114.429 176.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 39.8 ttpt -53.42 -52.16 60.27 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.515 1.126 . . . . 0.0 109.785 -175.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -58.86 -42.84 90.33 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 118.725 -0.655 . . . . 0.0 111.124 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 13.4 mt -61.55 -50.03 74.3 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 119.141 0.882 . . . . 0.0 111.459 176.486 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 62.0 mtpt -58.55 -46.41 86.92 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 122.191 -0.318 . . . . 0.0 110.221 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.81 -51.88 67.24 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 122.856 0.463 . . . . 0.0 110.998 173.773 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.0 mt -46.53 -61.1 1.97 Allowed 'General case' 0 C--N 1.333 -0.151 0 C-N-CA 123.747 0.819 . . . . 0.0 110.561 177.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 16.8 tt -59.41 -52.24 63.23 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 C-N-CA 119.829 -0.748 . . . . 0.0 110.157 -178.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -53.99 -50.35 66.79 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 123.604 0.761 . . . . 0.0 112.456 -175.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.06 -53.04 7.86 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 123.629 0.771 . . . . 0.0 110.266 -176.77 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 49.2 mm-40 -81.16 -24.38 37.6 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -167.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 47.4 mt . . . . . 0 CA--C 1.527 0.074 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 169.446 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 22.6 t70 . . . . . 0 C--O 1.227 -0.108 0 N-CA-C 110.194 -0.298 . . . . 0.0 110.194 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -36.4 -62.98 0.42 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.966 1.306 . . . . 0.0 113.415 -175.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 73.1 tt0 -59.35 -43.05 92.86 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.85 0.86 . . . . 0.0 111.004 -178.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -60.89 -53.72 45.24 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 N-CA-C 106.49 -1.67 . . . . 0.0 106.49 -173.834 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 66.6 t -56.01 -58.68 4.24 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 CA-C-O 118.154 -0.927 . . . . 0.0 108.647 176.256 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -41.22 -51.52 3.51 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 119.038 0.835 . . . . 0.0 112.403 -178.738 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 27.0 mt -55.92 -43.78 77.66 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -176.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 1.4 mpp? -82.07 -58.34 3.01 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.958 0.903 . . . . 0.0 109.997 -179.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -42.78 -31.29 0.46 Allowed 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 126.671 1.988 . . . . 0.0 111.954 176.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -37.2 -43.44 0.51 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.587 1.155 . . . . 0.0 113.261 172.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -58.02 -57.58 12.2 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.51 -0.744 . . . . 0.0 110.115 177.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -58.61 -45.41 89.25 Favored 'General case' 0 C--O 1.224 -0.289 0 C-N-CA 124.381 1.073 . . . . 0.0 110.361 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 43.0 tpt85 . . . . . 0 N--CA 1.451 -0.396 0 C-N-CA 126.074 1.75 . . . . 0.0 110.785 177.399 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 . . . . . 0 CA--C 1.533 0.309 0 CA-C-O 120.49 0.186 . . . . 0.0 110.657 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -122.35 143.69 34.21 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 C-N-CA 124.898 1.279 . . . . 0.0 108.647 175.246 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 17.4 p30 -92.77 -177.59 4.59 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 125.162 1.385 . . . . 0.0 111.589 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 49.4 t80 -47.37 -60.63 2.38 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.677 0.791 . . . . 0.0 112.769 175.696 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 47.8 tp60 -63.17 -34.63 78.05 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 119.489 1.041 . . . . 0.0 110.579 -175.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 72.2 mm-40 -58.26 -49.86 75.61 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.943 -0.473 . . . . 0.0 110.498 173.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -55.15 -50.02 70.35 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 122.947 0.499 . . . . 0.0 110.512 173.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 26.3 mm -57.26 -34.3 45.52 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 C-N-CA 123.207 0.603 . . . . 0.0 110.534 177.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 61.1 m -71.13 -39.29 72.09 Favored 'General case' 0 CA--C 1.531 0.227 0 O-C-N 121.568 -0.708 . . . . 0.0 110.684 176.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -57.17 -53.75 54.62 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 118.902 0.774 . . . . 0.0 109.959 173.26 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 53.6 mt -58.57 -42.35 87.77 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.804 0.335 . . . . 0.0 110.854 174.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.42 -46.05 88.09 Favored Glycine 0 CA--C 1.524 0.608 0 C-N-CA 124.244 0.926 . . . . 0.0 111.083 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.3 -49.28 74.63 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.362 0.665 . . . . 0.0 110.001 177.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -49.49 -59.63 3.58 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 122.472 1.13 . . . . 0.0 109.879 176.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -49.01 -59.75 3.35 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 113.663 -1.608 . . . . 0.0 110.254 178.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 22.7 ttp -63.87 -40.27 96.15 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.199 0.6 . . . . 0.0 112.004 -173.644 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 70.0 mt -62.94 -48.94 85.63 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 CA-C-O 117.77 -1.11 . . . . 0.0 109.679 -179.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.43 1.2 p90 -79.02 -33.54 44.75 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 117.812 -1.555 . . . . 0.0 113.975 179.117 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 32.1 m-80 -79.98 89.01 5.32 Favored 'General case' 0 C--N 1.334 -0.066 0 O-C-N 121.019 -1.051 . . . . 0.0 109.66 175.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -42.04 -42.32 2.84 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.573 0.749 . . . . 0.0 111.082 169.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.23 16.77 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 114.854 1.428 . . . . 0.0 114.854 178.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 46.9 mt . . . . . 0 CA--C 1.53 0.195 0 C-N-CA 125.136 1.374 . . . . 0.0 112.533 170.292 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.274 0 CA-C-O 121.011 0.434 . . . . 0.0 111.581 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.4 m -58.9 167.47 1.92 Allowed Pre-proline 0 CA--C 1.539 0.53 0 C-N-CA 124.688 1.195 . . . . 0.0 111.404 175.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_exo -48.27 -47.57 19.41 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 123.234 2.623 . . . . 0.0 112.988 178.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.2 mt -57.11 -49.74 74.95 Favored 'General case' 0 C--O 1.224 -0.278 0 C-N-CA 120.672 -0.411 . . . . 0.0 111.391 173.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -59.12 -40.43 85.38 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-N 118.614 0.643 . . . . 0.0 110.276 -177.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -63.02 -52.3 63.42 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.405 0.682 . . . . 0.0 110.703 176.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.47 -46.3 89.11 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.599 0.76 . . . . 0.0 111.322 -177.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 74.2 mt -52.88 -57.45 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 169.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -43.56 -46.41 7.13 Favored Glycine 0 CA--C 1.527 0.819 0 C-N-CA 125.925 1.726 . . . . 0.0 112.456 177.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 mt -54.7 -57.12 12.76 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.681 0.792 . . . . 0.0 110.774 172.742 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 11.0 mp -57.62 -42.02 82.47 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.52 -0.737 . . . . 0.0 111.976 178.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 18.6 mt -57.36 -56.42 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 C-N-CA 123.828 0.851 . . . . 0.0 110.08 175.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.92 -49.79 60.98 Favored Glycine 0 CA--C 1.52 0.404 0 N-CA-C 109.723 -1.351 . . . . 0.0 109.723 -177.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.8 mm -53.84 -46.86 63.99 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 C-N-CA 122.734 0.413 . . . . 0.0 110.558 175.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . 0.406 ' HB2' ' CE2' ' B' ' 73' ' ' TYR . 42.3 t80 -56.61 -64.2 0.95 Allowed 'General case' 0 N--CA 1.457 -0.114 0 CA-C-N 118.529 0.604 . . . . 0.0 110.004 175.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -58.28 -34.96 71.09 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 119.351 -0.356 . . . . 0.0 111.313 -169.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 64.8 tttm -50.48 -36.61 34.46 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.7 0.8 . . . . 0.0 112.177 175.514 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 77.3 m-85 -104.29 -41.95 5.63 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.186 0.595 . . . . 0.0 111.4 -178.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 96.5 p . . . . . 0 CA--C 1.531 0.221 0 O-C-N 121.556 -0.715 . . . . 0.0 111.349 -177.307 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 16.3 m170 . . . . . 0 CA--C 1.536 0.429 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 51.7 p -141.73 162.04 36.45 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.104 0.961 . . . . 0.0 110.036 177.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -161.21 179.8 8.07 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 118.045 -0.979 . . . . 0.0 108.92 172.329 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.3 t -137.93 -168.04 2.27 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 120.421 1.464 . . . . 0.0 112.254 -178.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 14.9 pttp -45.69 -51.41 12.45 Favored 'General case' 0 C--N 1.337 0.06 0 C-N-CA 126.318 1.847 . . . . 0.0 112.969 -169.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -53.34 -49.88 66.17 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 122.99 0.516 . . . . 0.0 110.346 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 19.1 mp0 -68.06 -37.12 80.93 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 119.272 -0.394 . . . . 0.0 110.419 -178.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 43.7 mt -62.91 -45.94 90.14 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 118.928 0.786 . . . . 0.0 110.93 177.18 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -57.57 -50.87 71.69 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 173.064 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 59.4 tt0 -51.42 -53.29 38.28 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.056 0.942 . . . . 0.0 110.594 178.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 12.8 mt -52.22 -65.08 0.62 Allowed 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 125.839 1.656 . . . . 0.0 109.82 177.108 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 14.3 tt -59.4 -45.51 93.44 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 120.037 -0.665 . . . . 0.0 109.934 -173.067 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 20.3 tt0 -51.16 -59.39 4.24 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.681 0.792 . . . . 0.0 111.551 177.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 9.1 mttm -78.33 -53.6 7.11 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-O 121.388 0.613 . . . . 0.0 110.815 -173.234 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 68.0 mm-40 -77.14 -21.45 54.12 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 118.278 -0.868 . . . . 0.0 112.924 -169.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 11.1 mt . . . . . 0 N--CA 1.461 0.095 0 CA-C-N 120.263 1.392 . . . . 0.0 108.948 170.185 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 . . . . . 0 CA--C 1.53 0.174 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.34 -56.31 0.15 Allowed 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 126.1 1.76 . . . . 0.0 114.479 -179.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 62.6 tt0 -63.8 -44.61 92.79 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 121.257 0.551 . . . . 0.0 110.9 -175.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.5 mp -61.25 -52.5 60.68 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 73.4 t -56.29 -44.55 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 C-N-CA 124.249 1.02 . . . . 0.0 110.231 -179.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -53.92 -55.13 29.74 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 119.194 0.906 . . . . 0.0 110.497 173.013 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 46.4 mt -53.78 -42.87 68.75 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 119.18 -0.438 . . . . 0.0 111.524 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 24.5 mmt -68.45 -61.79 1.68 Allowed 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.765 0.793 . . . . 0.0 109.832 178.22 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -43.89 -43.52 6.45 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 127.085 2.154 . . . . 0.0 111.199 -177.388 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -39.13 -49.07 1.79 Allowed 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.831 1.253 . . . . 0.0 112.42 178.229 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -60.03 -56.35 22.71 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.28 0.491 . . . . 0.0 109.89 -177.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -61.79 -35.5 78.36 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 124.291 1.037 . . . . 0.0 111.482 -177.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 10.9 ttp180 -67.11 -52.24 44.28 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 123.759 0.824 . . . . 0.0 109.611 179.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 . . . . . 0 CA--C 1.52 -0.181 0 CA-C-O 119.628 -0.225 . . . . 0.0 110.558 -171.877 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 41.5 mp0 . . . . . 0 N--CA 1.45 -0.454 0 N-CA-C 108.733 -0.839 . . . . 0.0 108.733 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 20.1 m -79.02 151.48 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 173.371 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -93.15 -175.93 4.0 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 123.832 0.853 . . . . 0.0 111.179 178.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -46.72 -66.08 0.46 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.109 0.964 . . . . 0.0 112.622 175.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 10.3 tp-100 -61.39 -35.1 76.54 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 119.756 1.162 . . . . 0.0 111.454 -174.056 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -64.51 -42.51 95.77 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 119.408 1.004 . . . . 0.0 111.252 175.424 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 73' ' ' TYR . . . . . 0.406 ' CE2' ' HB2' ' B' ' 16' ' ' PHE . 0.3 OUTLIER -54.81 -52.7 61.87 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 121.286 -0.884 . . . . 0.0 109.686 170.069 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 20.8 mm -53.68 -40.61 43.53 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.375 0 C-N-CA 122.947 0.499 . . . . 0.0 109.665 177.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 91.5 m -63.63 -28.37 69.87 Favored 'General case' 0 C--N 1.332 -0.178 0 C-N-CA 123.592 0.757 . . . . 0.0 111.338 178.307 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 10.7 t80 -60.51 -54.51 44.66 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.384 0.993 . . . . 0.0 108.996 171.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 70.1 mt -64.44 -37.98 89.44 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.183 0.593 . . . . 0.0 111.703 179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -70.63 -45.03 55.6 Favored Glycine 0 CA--C 1.523 0.541 0 N-CA-C 110.047 -1.221 . . . . 0.0 110.047 -176.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.88 -46.24 90.25 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 122.294 -0.533 . . . . 0.0 109.898 173.456 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 26.4 tp -51.52 -57.99 7.55 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.211 0.529 . . . . 0.0 109.882 175.132 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.14 -51.99 38.84 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 124.42 1.088 . . . . 0.0 110.691 177.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 57.7 ttm -56.47 -51.01 70.06 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 124.316 1.047 . . . . 0.0 110.82 -178.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.3 mt -66.35 -51.03 63.02 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 CA-C-O 118.088 -0.958 . . . . 0.0 109.882 -173.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.464 0.1 OUTLIER -76.98 -40.25 47.47 Favored 'General case' 0 C--N 1.347 0.478 0 CA-C-N 119.716 1.144 . . . . 0.0 113.373 -177.302 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 19.3 m-80 -82.98 64.88 7.83 Favored 'General case' 0 N--CA 1.461 0.077 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 169.166 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -47.38 -26.49 1.32 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.945 1.698 . . . . 0.0 113.961 -172.018 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -38.81 -45.16 1.11 Allowed 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.505 1.522 . . . . 0.0 111.92 167.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 86.8 mt . . . . . 0 CA--C 1.535 0.394 0 C-N-CA 125.235 1.414 . . . . 0.0 113.758 -177.789 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.197 0 CA-C-O 121.461 0.648 . . . . 0.0 111.98 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -53.5 163.82 0.95 Allowed Pre-proline 0 CA--C 1.54 0.568 0 C-N-CA 126.404 1.881 . . . . 0.0 111.627 172.552 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -51.65 -47.48 26.07 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 122.804 2.336 . . . . 0.0 112.309 176.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 8.6 mt -58.41 -50.43 73.71 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-N 118.322 0.51 . . . . 0.0 110.696 175.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -53.89 -48.81 69.73 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.147 0.431 . . . . 0.0 109.917 -178.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -57.78 -52.48 65.28 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.864 0.865 . . . . 0.0 110.919 177.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.31 -44.53 87.58 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.272 0.629 . . . . 0.0 111.781 -174.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 80.8 mt -54.54 -51.62 48.42 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 170.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.28 -49.64 14.37 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 124.358 0.98 . . . . 0.0 111.773 173.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.1 mt -55.61 -56.7 17.27 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 117.642 0.721 . . . . 0.0 111.094 174.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 9.9 mp -58.0 -43.39 86.58 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 119.357 0.98 . . . . 0.0 111.926 -177.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 75.4 mt -57.46 -55.88 18.5 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 C-N-CA 123.642 0.777 . . . . 0.0 110.131 174.035 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.81 -48.37 72.63 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.519 -1.032 . . . . 0.0 110.519 -177.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 7.4 mm -53.49 -48.57 57.8 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 C-N-CA 123.89 0.876 . . . . 0.0 109.975 174.278 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -56.47 -59.87 4.35 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.533 0.606 . . . . 0.0 109.96 177.076 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.6 t-80 -52.29 -38.34 58.12 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.218 1.007 . . . . 0.0 111.583 -177.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -56.51 -29.29 61.67 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.276 1.03 . . . . 0.0 112.163 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -110.8 -40.21 4.61 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.383 0.673 . . . . 0.0 112.262 -179.568 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 85.8 p . . . . . 0 CA--C 1.53 0.189 0 CA-C-N 119.462 1.028 . . . . 0.0 111.0 178.983 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 19.2 p . . . . . 0 N--CA 1.448 -0.534 0 N-CA-C 110.497 -0.186 . . . . 0.0 110.497 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -160.74 167.1 27.55 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 124.808 1.243 . . . . 0.0 108.219 168.553 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 6.5 t -121.12 -169.88 1.92 Allowed 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 122.391 1.091 . . . . 0.0 113.575 -172.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 43.5 pttt -45.97 -55.76 6.4 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 127.879 2.472 . . . . 0.0 113.564 -169.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -56.3 -51.83 66.76 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 -178.019 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -57.98 -41.62 83.34 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.386 0.675 . . . . 0.0 110.891 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 42.3 mt -65.73 -48.76 70.83 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.496 0.589 . . . . 0.0 111.862 178.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -58.3 -46.15 86.66 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 121.786 -0.571 . . . . 0.0 109.805 176.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -58.05 -49.33 77.26 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-O 118.889 -0.577 . . . . 0.0 110.42 174.575 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.1 mt -48.24 -52.3 21.67 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 119.513 1.051 . . . . 0.0 110.114 177.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 49.3 mt -56.56 -62.63 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.206 174.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.5 tt0 -49.2 -46.74 46.1 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.325 0.65 . . . . 0.0 112.599 -173.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.9 mmpt? -80.94 -53.92 6.03 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 125.592 1.557 . . . . 0.0 110.149 -171.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -95.22 -14.57 23.94 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -168.005 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.7 mt . . . . . 0 C--N 1.337 0.034 0 C-N-CA 125.327 1.451 . . . . 0.0 108.059 173.3 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.6 p-10 . . . . . 0 N--CA 1.464 0.267 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -36.2 -58.82 0.66 Allowed 'General case' 0 C--O 1.226 -0.17 0 C-N-CA 125.352 1.461 . . . . 0.0 113.593 -173.208 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -65.74 -39.87 91.55 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 120.771 0.319 . . . . 0.0 111.057 -173.076 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 2.1 mp -61.14 -54.88 29.16 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 178.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 80.6 t -56.25 -45.31 81.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 C-N-CA 123.973 0.909 . . . . 0.0 110.285 -179.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.19 -52.83 63.73 Favored 'General case' 0 C--O 1.23 0.053 0 CA-C-N 118.846 0.748 . . . . 0.0 110.235 176.367 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 61.5 mt -55.0 -40.44 70.13 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 119.282 -0.39 . . . . 0.0 111.192 -179.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.25 -67.74 0.44 Allowed 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 118.523 0.601 . . . . 0.0 109.645 174.23 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -39.7 -41.3 1.06 Allowed 'General case' 0 C--N 1.34 0.152 0 C-N-CA 127.37 2.268 . . . . 0.0 112.097 -177.125 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -38.64 -49.96 1.58 Allowed 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.825 1.25 . . . . 0.0 112.19 175.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.7 pp -60.87 -41.56 96.19 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 118.333 0.515 . . . . 0.0 110.95 -176.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -71.46 -42.72 67.82 Favored 'General case' 0 N--CA 1.457 -0.11 0 C-N-CA 123.619 0.768 . . . . 0.0 109.762 -178.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 14.5 ttm180 . . . . . 0 N--CA 1.453 -0.308 0 C-N-CA 123.894 0.877 . . . . 0.0 110.208 178.464 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 . . . . . 0 CA--C 1.534 0.328 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 11.0 m -79.55 143.3 12.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 170.206 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -83.38 167.81 17.18 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 122.78 0.432 . . . . 0.0 111.382 177.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 61.1 t80 -37.4 -59.18 0.78 Allowed 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.508 1.123 . . . . 0.0 113.149 177.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 53.8 tp60 -64.9 -32.22 73.82 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 119.716 1.144 . . . . 0.0 111.153 -175.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -68.87 -40.27 79.38 Favored 'General case' 0 CA--C 1.533 0.304 0 O-C-N 121.537 -0.727 . . . . 0.0 110.539 176.672 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -56.14 -51.94 66.13 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 169.584 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.416 ' CG2' ' CG2' ' B' ' 74' ' ' ILE . 24.5 mm -56.78 -35.86 47.5 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 O-C-N 121.915 -0.491 . . . . 0.0 110.305 176.669 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 90.2 m -71.69 -34.52 69.73 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 119.217 0.917 . . . . 0.0 111.42 176.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -58.73 -51.93 67.86 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 119.106 0.866 . . . . 0.0 108.923 171.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 64.3 mt -59.96 -40.92 90.68 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 120.926 0.393 . . . . 0.0 111.322 174.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -59.7 -47.28 91.69 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 110.533 -1.027 . . . . 0.0 110.533 -179.772 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.03 -48.3 82.4 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.925 0.89 . . . . 0.0 109.694 176.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 8.9 tp -51.06 -60.27 3.28 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-O 121.981 0.896 . . . . 0.0 110.002 177.031 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -49.14 -54.93 14.02 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 125.518 1.527 . . . . 0.0 110.528 179.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 18.4 ttp -67.92 -33.6 75.0 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.772 0.829 . . . . 0.0 111.99 -174.199 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 90.9 mt -67.49 -58.42 6.29 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.346 0 CA-C-O 118.407 -0.806 . . . . 0.0 108.99 176.3 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.417 0.7 OUTLIER -70.8 -38.89 73.37 Favored 'General case' 0 C--N 1.346 0.436 0 C-N-CA 118.173 -1.411 . . . . 0.0 112.521 -174.542 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 29.7 m-80 -82.18 65.44 7.31 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 168.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -46.99 -32.58 3.99 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.517 1.127 . . . . 0.0 113.004 -172.104 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.94 -52.25 0.43 Allowed 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.85 1.66 . . . . 0.0 112.494 168.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 90.1 mt . . . . . 0 CA--C 1.533 0.308 0 C-N-CA 124.2 1.0 . . . . 0.0 113.455 -174.634 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.216 0 CA-C-O 120.847 0.356 . . . . 0.0 110.222 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.7 m -51.26 159.86 1.02 Allowed Pre-proline 0 CA--C 1.537 0.468 0 C-N-CA 124.959 1.304 . . . . 0.0 110.688 173.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_exo -44.81 -49.87 9.09 Favored 'Trans proline' 0 N--CA 1.459 -0.52 0 C-N-CA 123.276 2.65 . . . . 0.0 113.401 -178.423 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.4 mt -57.95 -53.42 58.47 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 174.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -58.35 -40.44 82.22 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 118.265 0.484 . . . . 0.0 110.029 -175.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -64.12 -50.69 67.27 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.462 1.105 . . . . 0.0 110.52 178.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.35 -46.12 91.54 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.602 0.715 . . . . 0.0 111.103 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 64.9 mt -52.8 -53.01 23.13 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 170.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.76 -47.25 24.75 Favored Glycine 0 CA--C 1.527 0.796 0 C-N-CA 125.172 1.368 . . . . 0.0 111.784 176.082 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 mt -55.93 -55.34 33.82 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 117.606 0.703 . . . . 0.0 110.89 173.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -57.54 -43.66 84.55 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 118.864 0.757 . . . . 0.0 111.612 -179.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 89.1 mt -58.35 -52.75 55.32 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 C-N-CA 123.554 0.741 . . . . 0.0 110.69 174.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.0 -51.97 50.08 Favored Glycine 0 CA--C 1.523 0.543 0 N-CA-C 109.614 -1.394 . . . . 0.0 109.614 -178.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 9.1 mm -53.51 -49.93 52.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 C-N-CA 123.635 0.774 . . . . 0.0 110.474 175.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -51.76 -59.46 4.28 Favored 'General case' 0 C--N 1.339 0.134 0 CA-C-O 120.929 0.395 . . . . 0.0 110.059 178.321 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 67.9 t60 -55.04 -46.39 75.31 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.262 0.625 . . . . 0.0 110.635 -177.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -51.15 -28.83 11.89 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 125.546 1.539 . . . . 0.0 112.721 -179.423 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -132.27 44.6 2.87 Favored 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 119.006 0.821 . . . . 0.0 110.01 173.367 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 58.6 p . . . . . 0 CA--C 1.533 0.305 0 CA-C-O 121.601 0.715 . . . . 0.0 111.769 -176.986 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 19.2 m80 . . . . . 0 CA--C 1.54 0.568 0 CA-C-O 119.755 -0.164 . . . . 0.0 111.358 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 3.4 p -128.84 169.85 14.08 Favored 'General case' 0 C--O 1.232 0.151 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 169.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 4.3 pp -159.34 -170.84 3.1 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.593 0.757 . . . . 0.0 109.619 175.247 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 14.4 m -149.69 178.82 8.52 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.125 -0.984 . . . . 0.0 111.357 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 19.4 pttm -37.23 -53.2 1.06 Allowed 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 126.576 1.95 . . . . 0.0 113.727 -179.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 23.1 ttmm -50.98 -50.35 58.39 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.782 0.833 . . . . 0.0 110.544 178.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 25.8 mp0 -67.39 -39.01 85.56 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 118.723 -0.656 . . . . 0.0 110.143 -178.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 78.0 mt -60.36 -46.43 89.98 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.373 0.988 . . . . 0.0 111.127 175.476 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -56.8 -51.43 68.96 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 175.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -55.64 -48.22 75.33 Favored 'General case' 0 C--O 1.22 -0.448 0 CA-C-N 117.861 0.3 . . . . 0.0 111.361 175.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 15.1 mt -51.77 -53.52 38.84 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 121.504 -0.748 . . . . 0.0 109.776 -178.739 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 1.4 mp -57.13 -58.14 7.13 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 174.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -53.5 -47.77 69.58 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.574 0.75 . . . . 0.0 112.037 -172.085 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 10.7 mmpt? -82.66 -49.39 9.86 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 125.204 1.402 . . . . 0.0 110.211 -173.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 52.7 mm-40 -98.98 -2.47 37.29 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-O 117.248 -1.358 . . . . 0.0 114.424 -167.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 72.1 mt . . . . . 0 N--CA 1.462 0.175 0 CA-C-N 120.673 1.579 . . . . 0.0 110.214 169.666 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 . . . . . 0 N--CA 1.464 0.243 0 N-CA-C 114.959 1.466 . . . . 0.0 114.959 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.94 -60.58 0.16 Allowed 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 125.851 1.661 . . . . 0.0 113.524 -178.362 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -68.55 -34.57 76.08 Favored 'General case' 0 N--CA 1.457 -0.111 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -174.085 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.2 mp -65.87 -52.54 48.25 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 -178.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 80.3 t -54.31 -45.49 68.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 C-N-CA 123.699 0.799 . . . . 0.0 110.093 174.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.41 -50.64 72.36 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 118.482 0.583 . . . . 0.0 110.926 177.263 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 54.4 mt -56.19 -39.87 73.09 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.202 0.601 . . . . 0.0 111.284 178.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.44 -64.95 0.75 Allowed 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 118.762 0.71 . . . . 0.0 109.085 174.186 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -40.51 -42.51 1.66 Allowed 'General case' 0 N--CA 1.463 0.209 0 C-N-CA 126.637 1.975 . . . . 0.0 111.943 -178.147 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -38.13 -48.65 1.26 Allowed 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 126.001 1.72 . . . . 0.0 112.634 177.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.6 pp -63.11 -42.23 99.51 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 121.078 -0.249 . . . . 0.0 110.833 -176.288 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -73.59 -37.76 65.34 Favored 'General case' 0 N--CA 1.457 -0.085 0 C-N-CA 123.791 0.836 . . . . 0.0 110.257 -178.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 15.6 ttm180 -58.38 -48.5 80.4 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.325 0.65 . . . . 0.0 109.614 175.092 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 . . . . . 0 C--O 1.232 0.166 0 C-N-CA 122.222 0.209 . . . . 0.0 111.311 -174.412 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 26.9 mp0 . . . . . 0 N--CA 1.453 -0.277 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 29.5 m -85.91 155.86 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 CA-C-O 121.33 0.586 . . . . 0.0 109.896 -177.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 16.7 p30 -105.17 -176.79 3.18 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 126.184 1.794 . . . . 0.0 110.928 179.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -52.93 -63.48 1.13 Allowed 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 123.637 0.775 . . . . 0.0 112.183 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -62.76 -32.68 73.87 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 119.703 1.138 . . . . 0.0 111.327 -175.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -59.16 -50.52 73.72 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 119.525 1.057 . . . . 0.0 110.666 173.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -53.9 -49.75 67.9 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.957 -0.464 . . . . 0.0 110.227 173.245 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.416 ' CG2' ' CG2' ' A' ' 74' ' ' ILE . 26.2 mm -60.85 -27.18 40.65 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 O-C-N 121.934 -0.479 . . . . 0.0 111.18 177.343 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 83.6 m -76.12 -33.94 59.46 Favored 'General case' 0 C--N 1.333 -0.114 0 O-C-N 120.898 -1.126 . . . . 0.0 110.154 173.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -57.34 -57.98 10.26 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 169.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 48.4 mt -61.37 -40.31 93.84 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 120.943 0.401 . . . . 0.0 111.996 179.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.3 -47.06 65.81 Favored Glycine 0 CA--C 1.524 0.651 0 N-CA-C 110.721 -0.952 . . . . 0.0 110.721 -176.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.28 -44.58 87.54 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 121.867 -0.784 . . . . 0.0 110.174 176.228 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 13.9 tp -48.29 -56.83 7.04 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.604 0.761 . . . . 0.0 110.145 172.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.05 -55.0 23.39 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.474 1.11 . . . . 0.0 110.612 175.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 39.5 ttm -51.33 -47.13 62.79 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.243 1.017 . . . . 0.0 110.982 -178.136 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 60.6 mt -68.8 -61.21 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-O 118.321 -0.847 . . . . 0.0 110.566 178.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.39 0.3 OUTLIER -65.7 -44.47 86.06 Favored 'General case' 0 C--N 1.346 0.434 0 C-N-CA 117.891 -1.524 . . . . 0.0 112.02 -171.331 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 64.7 m-80 -82.94 62.57 6.57 Favored 'General case' 0 C--O 1.228 -0.047 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 169.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -49.21 -30.07 6.49 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.196 1.398 . . . . 0.0 112.268 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -40.37 -37.94 0.74 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.795 1.638 . . . . 0.0 113.138 169.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 28.5 mt . . . . . 0 CA--C 1.53 0.185 0 C-N-CA 123.788 0.835 . . . . 0.0 111.988 176.831 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.258 0 CA-C-O 121.084 0.468 . . . . 0.0 110.75 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.1 m -57.39 165.78 1.95 Allowed Pre-proline 0 CA--C 1.54 0.594 0 C-N-CA 124.915 1.286 . . . . 0.0 111.885 178.039 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -47.19 -47.43 17.11 Favored 'Trans proline' 0 N--CA 1.458 -0.578 0 C-N-CA 123.575 2.85 . . . . 0.0 113.376 178.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.7 mt -55.42 -49.62 71.93 Favored 'General case' 0 C--N 1.341 0.204 0 CA-C-N 118.01 0.368 . . . . 0.0 111.495 173.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -61.52 -41.31 97.13 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 -176.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 17.0 tt0 -60.48 -51.78 67.99 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.33 0.652 . . . . 0.0 110.831 175.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.06 -45.83 90.35 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.527 0.731 . . . . 0.0 111.227 -177.296 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 66.7 mt -53.1 -53.5 22.16 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 169.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -45.78 -47.83 13.49 Favored Glycine 0 CA--C 1.528 0.902 0 C-N-CA 125.188 1.375 . . . . 0.0 112.156 175.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.0 mt -54.95 -56.48 19.19 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 117.733 0.766 . . . . 0.0 110.861 173.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.4 mp -58.17 -43.95 87.73 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 121.611 -0.681 . . . . 0.0 111.601 -179.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 60.7 mt -55.41 -56.04 13.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.18 0 C-N-CA 123.727 0.811 . . . . 0.0 109.975 174.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.01 -49.63 61.92 Favored Glycine 0 CA--C 1.523 0.56 0 N-CA-C 110.268 -1.133 . . . . 0.0 110.268 -177.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 8.8 mm -53.34 -48.5 56.16 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 C-N-CA 123.242 0.617 . . . . 0.0 110.454 176.52 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -56.54 -60.93 2.82 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 121.684 0.754 . . . . 0.0 109.892 175.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -53.76 -37.39 63.36 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.854 1.262 . . . . 0.0 111.616 -172.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.5 tttp -50.28 -36.92 33.59 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.2 1.0 . . . . 0.0 111.855 177.151 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -102.28 -52.14 3.2 Favored 'General case' 0 CA--C 1.528 0.111 0 C-N-CA 123.064 0.545 . . . . 0.0 109.682 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.6 m . . . . . 0 N--CA 1.453 -0.292 0 O-C-N 121.759 -0.588 . . . . 0.0 112.431 -175.549 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.9 p . . . . . 0 N--CA 1.453 -0.309 0 CA-C-O 121.08 0.467 . . . . 0.0 111.431 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -151.62 164.34 37.1 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 124.088 0.955 . . . . 0.0 109.079 168.12 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 84.3 p -87.04 165.28 15.93 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.66 1.184 . . . . 0.0 113.125 -172.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 24.2 pttm -48.83 -47.34 42.54 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.395 168.075 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -57.28 -53.28 59.88 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 124.542 1.137 . . . . 0.0 109.37 178.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -56.62 -43.65 80.42 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 118.208 -0.901 . . . . 0.0 111.812 178.146 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.8 mt -60.4 -52.29 65.84 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 119.881 1.219 . . . . 0.0 111.597 175.549 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.9 mtmt -58.48 -38.21 77.12 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 122.374 0.27 . . . . 0.0 110.803 -178.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -60.62 -70.39 0.18 Allowed 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 168.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.3 mt -32.16 -60.23 0.28 Allowed 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 126.175 1.79 . . . . 0.0 112.341 -176.397 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 15.4 tt -56.34 -54.17 31.21 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 O-C-N 123.464 0.477 . . . . 0.0 109.874 -173.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -69.01 -40.46 78.66 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.851 -0.531 . . . . 0.0 111.733 -176.389 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.8 mmpt? -60.93 -54.26 47.14 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 123.692 0.797 . . . . 0.0 109.691 -178.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 65.8 mm-40 -84.68 -49.96 8.05 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.399 -169.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 98.4 mt . . . . . 0 C--N 1.339 0.128 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 170.428 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 . . . . . 0 N--CA 1.462 0.165 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -36.87 -51.16 0.89 Allowed 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 124.661 1.184 . . . . 0.0 112.799 179.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -65.95 -39.32 90.34 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 121.256 0.55 . . . . 0.0 111.103 -175.195 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 1.1 mp -65.36 -51.98 57.71 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 N-CA-C 106.904 -1.517 . . . . 0.0 106.904 -179.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 84.6 t -56.69 -44.17 80.76 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 C-N-CA 123.892 0.877 . . . . 0.0 110.324 178.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -56.65 -53.45 57.5 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 118.65 0.659 . . . . 0.0 110.195 173.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 40.8 mt -53.13 -44.3 67.61 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 119.204 -0.427 . . . . 0.0 111.521 178.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 26.2 mmt -64.89 -57.82 7.79 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.797 0.808 . . . . 0.0 109.885 177.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -56.29 -32.94 65.05 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 125.272 1.429 . . . . 0.0 111.835 -173.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -38.59 -47.66 1.34 Allowed 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 125.314 1.446 . . . . 0.0 112.397 -178.191 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -55.83 -48.33 75.65 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 122.348 0.259 . . . . 0.0 110.708 -178.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -67.61 -45.34 75.72 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 123.139 0.576 . . . . 0.0 110.198 176.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 14.2 ttt85 . . . . . 0 CA--C 1.533 0.291 0 C-N-CA 123.954 0.902 . . . . 0.0 111.014 -178.932 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.5 mp0 . . . . . 0 CA--C 1.53 0.198 0 CA-C-O 120.202 0.049 . . . . 0.0 111.107 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 15.5 m -137.03 156.31 34.13 Favored 'Isoleucine or valine' 0 C--O 1.235 0.303 0 C-N-CA 125.37 1.468 . . . . 0.0 108.844 168.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -88.67 168.48 12.48 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 124.016 0.926 . . . . 0.0 111.622 175.142 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -36.63 -62.0 0.49 Allowed 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.512 1.125 . . . . 0.0 113.447 172.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 43.7 tp60 -63.29 -34.09 76.94 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 120.851 -1.156 . . . . 0.0 111.235 -174.28 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -66.28 -41.4 89.87 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.366 -0.834 . . . . 0.0 110.371 175.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -54.49 -49.27 70.53 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 121.614 -0.678 . . . . 0.0 109.651 169.74 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.407 ' CG2' ' CG2' ' B' ' 74' ' ' ILE . 29.6 mm -58.65 -32.8 47.09 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 O-C-N 121.764 -0.585 . . . . 0.0 110.676 175.3 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 25.5 m -72.13 -30.97 65.58 Favored 'General case' 0 CA--C 1.534 0.345 0 O-C-N 121.232 -0.917 . . . . 0.0 111.253 175.363 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -61.77 -56.48 19.05 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.083 -1.011 . . . . 0.0 108.739 171.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 49.2 mt -61.49 -41.97 98.08 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 120.875 0.369 . . . . 0.0 111.418 178.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.8 -46.36 89.88 Favored Glycine 0 CA--C 1.523 0.587 0 N-CA-C 110.663 -0.975 . . . . 0.0 110.663 -178.215 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.97 -45.91 92.84 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 117.97 0.885 . . . . 0.0 110.423 174.758 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 16.8 tp -51.73 -55.74 17.85 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.18 0.514 . . . . 0.0 109.807 176.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.83 -56.14 15.74 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 124.75 1.22 . . . . 0.0 110.163 179.261 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 54.5 ttm -50.43 -52.6 36.32 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 125.6 1.56 . . . . 0.0 110.574 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 71.3 mt -64.84 -64.41 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.346 0 CA-C-O 118.748 -0.644 . . . . 0.0 109.403 -177.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.448 0.1 OUTLIER -67.47 -37.1 82.39 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 118.314 -1.354 . . . . 0.0 113.253 -169.245 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 24.1 m-80 -81.51 68.79 7.98 Favored 'General case' 0 N--CA 1.461 0.101 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 170.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -37.62 -46.64 0.88 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.503 1.521 . . . . 0.0 111.619 -176.074 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -30.93 -53.51 0.19 Allowed 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 126.756 2.022 . . . . 0.0 113.506 171.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 18.7 mt . . . . . 0 C--O 1.224 -0.261 0 C-N-CA 123.996 0.919 . . . . 0.0 111.95 -178.293 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.239 0 CA-C-O 120.794 0.33 . . . . 0.0 110.621 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 13.0 m -50.74 156.37 1.63 Allowed Pre-proline 0 CA--C 1.542 0.656 0 C-N-CA 123.56 0.744 . . . . 0.0 111.008 170.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -47.11 -51.5 9.29 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 123.23 2.62 . . . . 0.0 113.465 -178.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 4.9 mt -52.79 -46.89 67.84 Favored 'General case' 0 C--O 1.227 -0.124 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 172.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -63.48 -40.62 97.58 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 118.16 0.436 . . . . 0.0 110.1 -177.045 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 14.1 tp60 -63.4 -46.3 87.07 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 122.438 0.295 . . . . 0.0 110.7 175.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.76 -47.02 85.33 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.357 0.599 . . . . 0.0 110.872 -179.157 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 65.1 mt -53.15 -53.39 23.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 169.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.29 -44.8 21.11 Favored Glycine 0 CA--C 1.527 0.822 0 C-N-CA 125.588 1.566 . . . . 0.0 112.02 176.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.6 mt -57.27 -55.57 33.11 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 117.569 0.685 . . . . 0.0 110.587 173.612 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.9 mp -57.86 -41.99 83.58 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 118.996 0.816 . . . . 0.0 111.647 179.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 66.7 mt -57.13 -56.37 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 C-N-CA 123.841 0.856 . . . . 0.0 110.736 173.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.07 -50.55 58.62 Favored Glycine 0 CA--C 1.521 0.444 0 N-CA-C 109.751 -1.34 . . . . 0.0 109.751 -177.206 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 12.5 mm -52.1 -49.06 41.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 C-N-CA 123.47 0.708 . . . . 0.0 110.474 174.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -55.49 -65.36 0.6 Allowed 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 118.31 0.505 . . . . 0.0 110.18 178.335 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -58.92 -30.67 68.01 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 118.205 -0.902 . . . . 0.0 112.707 -174.398 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 65.3 tttp -49.13 -36.71 19.75 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 119.301 0.955 . . . . 0.0 111.293 173.33 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -100.68 -56.73 2.26 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 122.935 0.494 . . . . 0.0 110.169 177.459 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 CA--C 1.533 0.326 0 CA-C-N 118.832 0.742 . . . . 0.0 111.589 -176.83 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 23.6 t-160 . . . . . 0 N--CA 1.451 -0.393 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 32.2 p -133.48 160.83 36.25 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 125.177 1.391 . . . . 0.0 111.429 -174.208 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -161.34 177.72 9.88 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.831 1.252 . . . . 0.0 108.668 168.477 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.4 t -131.83 -169.44 2.2 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 120.259 1.39 . . . . 0.0 112.241 -175.112 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 19.2 pttp -42.25 -53.54 4.07 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 127.877 2.471 . . . . 0.0 113.227 -174.062 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 3.2 tppp? -55.67 -53.41 56.94 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 123.517 0.727 . . . . 0.0 109.568 -178.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 28.2 mp0 -64.44 -38.04 89.64 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.289 -176.65 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 43.6 mt -61.9 -52.59 63.46 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 118.542 0.61 . . . . 0.0 111.228 177.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -61.88 -43.78 98.14 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.545 -0.722 . . . . 0.0 110.506 178.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 71.6 tt0 -53.24 -51.96 60.51 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.758 0.823 . . . . 0.0 110.363 174.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 7.9 mt -49.49 -56.95 8.01 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 124.552 1.141 . . . . 0.0 110.13 177.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 33.7 mm -53.92 -58.99 2.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 177.503 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -54.31 -47.06 72.88 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.272 0.629 . . . . 0.0 112.425 -172.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -78.1 -56.28 4.6 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 122.096 -0.377 . . . . 0.0 110.745 -178.316 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -82.59 -20.55 36.26 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 -167.163 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 76.1 mt . . . . . 0 N--CA 1.457 -0.115 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 168.779 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 . . . . . 0 C--O 1.226 -0.136 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.4 -57.41 0.15 Allowed 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 126.027 1.731 . . . . 0.0 113.906 -178.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -67.4 -41.91 84.15 Favored 'General case' 0 N--CA 1.457 -0.083 0 CA-C-O 120.849 0.356 . . . . 0.0 111.166 -174.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.4 mp -60.65 -52.08 65.64 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 N-CA-C 107.066 -1.457 . . . . 0.0 107.066 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 78.4 t -54.49 -53.37 31.52 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 C-N-CA 123.914 0.886 . . . . 0.0 109.428 177.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -50.28 -55.17 16.57 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 119.317 0.962 . . . . 0.0 110.927 176.932 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 68.1 mt -54.67 -43.47 72.45 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 122.593 0.357 . . . . 0.0 111.655 -175.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -75.55 -59.67 2.65 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 118.097 0.408 . . . . 0.0 111.09 177.857 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -40.88 -43.71 2.12 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 126.458 1.903 . . . . 0.0 111.447 178.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -38.52 -49.01 1.47 Allowed 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 125.046 1.338 . . . . 0.0 112.547 176.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -58.6 -47.02 85.72 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 -176.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -67.91 -44.04 77.85 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 122.736 0.415 . . . . 0.0 110.724 178.44 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 11.2 ttp180 -56.55 -46.28 80.79 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.664 0.786 . . . . 0.0 110.095 -178.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 . . . . . 0 N--CA 1.454 -0.236 0 C-N-CA 122.879 0.472 . . . . 0.0 111.179 -174.904 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 . . . . . 0 N--CA 1.452 -0.359 0 N-CA-C 106.237 -1.764 . . . . 0.0 106.237 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 12.2 m -78.17 140.22 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 -179.181 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -81.36 167.06 19.88 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.551 0.215 . . . . 0.0 110.71 175.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -32.37 -61.04 0.27 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.978 1.311 . . . . 0.0 112.902 171.589 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 37.8 tp60 -61.35 -33.3 73.39 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.604 1.093 . . . . 0.0 112.128 -174.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -72.53 -38.77 67.94 Favored 'General case' 0 C--O 1.236 0.35 0 O-C-N 121.338 -0.851 . . . . 0.0 110.16 177.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -56.14 -50.74 70.27 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 169.675 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.407 ' CG2' ' CG2' ' A' ' 74' ' ' ILE . 25.8 mm -55.82 -41.17 65.31 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 175.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 58.4 m -60.03 -37.95 81.28 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 118.976 0.807 . . . . 0.0 110.94 176.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 20.7 t80 -57.09 -53.97 52.1 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 121.726 -0.608 . . . . 0.0 109.842 174.223 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 60.2 mt -62.98 -38.27 90.45 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.979 0.419 . . . . 0.0 111.893 179.113 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.65 -43.51 84.99 Favored Glycine 0 CA--C 1.522 0.508 0 N-CA-C 110.0 -1.24 . . . . 0.0 110.0 -178.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.74 -48.31 82.37 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 117.553 0.676 . . . . 0.0 109.881 173.438 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 9.1 tp -50.39 -57.7 7.37 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 121.429 0.633 . . . . 0.0 110.054 175.426 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.5 -56.64 10.71 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 124.877 1.271 . . . . 0.0 110.433 179.018 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 43.8 ttm -52.57 -49.66 64.51 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 125.555 1.542 . . . . 0.0 110.665 -179.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 58.3 mt -69.84 -50.02 52.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-O 117.894 -1.051 . . . . 0.0 110.262 -172.503 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.451 1.2 p90 -76.52 -37.93 55.94 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 120.166 1.348 . . . . 0.0 113.381 -178.573 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -81.29 67.4 7.21 Favored 'General case' 0 N--CA 1.463 0.203 0 O-C-N 121.102 -0.999 . . . . 0.0 108.692 173.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -41.54 -42.03 2.29 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.259 1.424 . . . . 0.0 111.464 179.303 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.5 -47.67 0.23 Allowed 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 126.192 1.797 . . . . 0.0 113.575 172.063 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 47.7 mt . . . . . 0 N--CA 1.457 -0.082 0 C-N-CA 122.807 0.443 . . . . 0.0 110.832 178.431 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.236 0 CA-C-O 120.737 0.303 . . . . 0.0 110.533 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.1 m -51.13 157.62 1.46 Allowed Pre-proline 0 CA--C 1.538 0.488 0 C-N-CA 125.031 1.332 . . . . 0.0 111.427 176.272 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_exo -46.45 -49.64 11.53 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 123.28 2.653 . . . . 0.0 112.929 -179.188 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.0 mt -58.54 -45.78 88.17 Favored 'General case' 0 C--O 1.225 -0.217 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 175.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -61.34 -43.26 99.16 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-N 118.3 0.5 . . . . 0.0 109.656 -177.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -60.71 -49.78 76.13 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.518 0.727 . . . . 0.0 110.573 176.413 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.47 -45.89 90.96 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.276 0.63 . . . . 0.0 111.388 -178.349 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 65.5 mt -53.78 -51.64 42.29 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 170.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.73 -48.84 17.59 Favored Glycine 0 CA--C 1.527 0.81 0 C-N-CA 124.733 1.159 . . . . 0.0 112.013 174.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.1 mt -55.51 -56.49 19.66 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 117.749 0.775 . . . . 0.0 111.062 174.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.23 -42.74 86.97 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 118.586 0.63 . . . . 0.0 111.451 -178.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 79.0 mt -58.24 -52.34 60.03 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 C-N-CA 123.578 0.751 . . . . 0.0 110.586 173.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.72 -50.65 59.7 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.069 -1.212 . . . . 0.0 110.069 -178.378 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 8.6 mm -52.94 -48.82 50.98 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 C-N-CA 123.306 0.642 . . . . 0.0 110.093 175.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -55.57 -59.01 5.43 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 120.71 0.291 . . . . 0.0 110.527 177.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 5.6 t-80 -55.36 -39.83 70.55 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 124.252 1.021 . . . . 0.0 111.061 -175.544 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -48.25 -34.49 10.39 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.653 0.781 . . . . 0.0 112.064 -178.37 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -107.16 -53.59 2.59 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.41 0.684 . . . . 0.0 109.793 178.1 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.8 m . . . . . 0 N--CA 1.454 -0.241 0 C-N-CA 123.894 0.878 . . . . 0.0 112.267 -172.909 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 6.9 p . . . . . 0 CA--C 1.533 0.294 0 CA-C-O 120.771 0.319 . . . . 0.0 110.84 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -154.44 174.63 14.62 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 124.342 1.057 . . . . 0.0 109.258 169.608 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.6 p -127.0 168.06 15.06 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.52 1.128 . . . . 0.0 112.831 -171.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.3 pttp -32.26 -61.34 0.26 Allowed 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 127.515 2.326 . . . . 0.0 113.921 177.47 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 20.5 tptp -54.66 -47.25 73.78 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 121.881 -0.512 . . . . 0.0 111.368 -179.27 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -61.81 -40.99 97.19 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 119.183 -0.437 . . . . 0.0 109.932 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 26.2 mt -63.13 -48.38 78.72 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 118.264 0.484 . . . . 0.0 111.437 176.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 9.1 mtpm? -61.93 -36.55 81.7 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.291 0.636 . . . . 0.0 110.966 179.193 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.58 -54.22 30.96 Favored 'General case' 0 C--O 1.224 -0.262 0 O-C-N 122.103 -0.373 . . . . 0.0 110.656 169.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.1 mt -43.77 -71.93 0.07 Allowed 'General case' 0 C--O 1.227 -0.108 0 C-N-CA 124.638 1.175 . . . . 0.0 110.29 178.288 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 12.9 tt -50.72 -50.66 22.26 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 CA-C-O 121.777 0.799 . . . . 0.0 110.212 -170.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -53.9 -47.13 71.45 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 126.324 1.85 . . . . 0.0 111.87 177.657 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.26 -55.37 5.78 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.944 0.498 . . . . 0.0 110.658 -175.668 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . 0.261 0.0 OUTLIER -91.27 -7.58 50.75 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 114.898 1.444 . . . . 0.0 114.898 -168.587 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 62.5 mt . . . . . 0 C--O 1.231 0.109 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 167.893 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 . . . . . 0 CA--C 1.531 0.217 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -28.53 -57.53 0.13 Allowed 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 126.909 2.083 . . . . 0.0 113.89 178.025 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 63.4 tt0 -66.84 -40.99 88.15 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 121.075 0.464 . . . . 0.0 110.901 -173.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 1.8 mp -64.8 -51.24 69.6 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 82.8 t -55.68 -43.06 72.03 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 C-N-CA 123.964 0.906 . . . . 0.0 110.098 177.559 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.27 -52.2 66.69 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 119.583 1.083 . . . . 0.0 111.003 174.673 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 37.5 mt -53.36 -41.44 65.84 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 119.491 -0.29 . . . . 0.0 111.401 179.156 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.5 -62.4 1.42 Allowed 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.399 0.545 . . . . 0.0 110.139 176.43 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -43.53 -39.98 3.7 Favored 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 126.996 2.118 . . . . 0.0 111.572 -177.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -39.0 -49.7 1.72 Allowed 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 124.165 0.986 . . . . 0.0 112.261 173.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.4 mp -60.84 -48.37 82.12 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 -177.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -61.29 -54.0 49.58 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.095 0.558 . . . . 0.0 109.73 179.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.6 ttm180 . . . . . 0 N--CA 1.453 -0.291 0 C-N-CA 124.599 1.16 . . . . 0.0 110.219 178.02 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 . . . . . 0 N--CA 1.453 -0.304 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.7 m -132.0 151.1 34.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 C-N-CA 125.791 1.636 . . . . 0.0 106.976 169.269 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -90.31 170.94 9.83 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 123.321 0.648 . . . . 0.0 111.037 175.253 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 73.6 t80 -34.51 -63.89 0.28 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.987 1.315 . . . . 0.0 113.123 171.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 50.3 tp60 -63.26 -32.34 73.73 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.768 1.167 . . . . 0.0 111.496 -173.064 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -68.45 -41.2 80.61 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 121.262 -0.899 . . . . 0.0 110.246 176.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -56.58 -50.54 71.64 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 170.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.6 mm -56.28 -38.3 54.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 O-C-N 121.848 -0.533 . . . . 0.0 110.087 176.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 90.4 m -66.63 -38.24 86.5 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 121.465 -0.772 . . . . 0.0 111.035 175.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -54.85 -54.49 41.68 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 172.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 53.8 mt -59.95 -40.89 90.56 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 111.763 0.283 . . . . 0.0 111.763 176.272 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.07 -47.05 91.8 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 110.895 -0.882 . . . . 0.0 110.895 -177.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.32 -45.21 81.09 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.37 0.668 . . . . 0.0 109.948 177.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 59.0 tp -49.53 -58.67 4.76 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.369 0.604 . . . . 0.0 109.983 173.573 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -48.59 -58.57 4.51 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 124.46 1.104 . . . . 0.0 110.294 176.006 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 56.5 ttm -50.89 -57.52 8.29 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 122.994 0.518 . . . . 0.0 110.883 -178.158 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 31.6 mt -61.04 -38.33 79.31 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 CA-C-O 117.937 -1.03 . . . . 0.0 110.91 -172.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.382 0.0 OUTLIER -97.05 7.65 46.19 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 115.229 1.566 . . . . 0.0 115.229 176.704 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -122.99 87.71 2.8 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 119.596 1.089 . . . . 0.0 109.883 169.229 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -38.48 -42.39 0.75 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 126.041 1.737 . . . . 0.0 113.796 176.173 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -45.93 -46.32 16.04 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.385 0.674 . . . . 0.0 111.625 176.571 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 91.6 mt . . . . . 0 CA--C 1.534 0.344 0 C-N-CA 123.618 0.767 . . . . 0.0 112.97 -177.567 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.175 0 CA-C-O 121.174 0.511 . . . . 0.0 110.112 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.4 m -56.17 164.17 1.99 Allowed Pre-proline 0 CA--C 1.54 0.558 0 C-N-CA 124.256 1.023 . . . . 0.0 111.339 174.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo -47.56 -50.52 11.29 Favored 'Trans proline' 0 N--CA 1.458 -0.602 0 C-N-CA 123.013 2.475 . . . . 0.0 112.72 177.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 1.7 mt -60.52 -39.68 88.66 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-O 118.887 -0.578 . . . . 0.0 112.423 174.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -61.11 -45.88 92.86 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 119.291 0.951 . . . . 0.0 109.152 -179.304 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.9 tp60 -63.81 -43.92 94.81 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.717 -0.22 . . . . 0.0 111.081 177.106 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.31 -46.76 75.8 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.741 -0.599 . . . . 0.0 111.408 -177.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 76.7 mt -55.3 -52.16 48.53 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 170.268 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -45.19 -47.33 10.56 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 124.897 1.237 . . . . 0.0 111.906 174.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.5 mt -56.36 -59.01 5.58 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.442 0.697 . . . . 0.0 110.518 173.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.6 mp -57.25 -42.35 81.37 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 119.496 1.044 . . . . 0.0 112.061 -177.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 55.9 mt -58.77 -56.82 14.23 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 123.953 0.901 . . . . 0.0 110.439 174.168 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.06 -49.14 69.06 Favored Glycine 0 CA--C 1.522 0.513 0 N-CA-C 110.193 -1.163 . . . . 0.0 110.193 -176.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 8.5 mm -50.48 -53.51 12.26 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 C-N-CA 124.393 1.077 . . . . 0.0 109.99 174.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -52.64 -62.98 1.3 Allowed 'General case' 0 CA--C 1.528 0.117 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 177.079 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -51.03 -39.52 56.08 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.92 0.888 . . . . 0.0 111.745 -175.066 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -52.22 -34.82 47.38 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.969 0.907 . . . . 0.0 111.982 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 94.6 m-85 -111.42 -35.61 5.77 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 118.3 0.5 . . . . 0.0 112.18 -177.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.6 m . . . . . 0 CA--C 1.532 0.257 0 CA-C-N 119.028 0.831 . . . . 0.0 111.003 174.701 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 38.8 p-80 . . . . . 0 CA--C 1.538 0.493 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 17.0 p -135.72 171.93 13.75 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 126.79 2.036 . . . . 0.0 106.352 174.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.91 168.58 24.33 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 118.756 0.707 . . . . 0.0 110.485 173.836 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.4 t -116.25 -178.57 3.44 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.341 1.056 . . . . 0.0 112.256 -175.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 55.0 mttm -35.68 -66.61 0.19 Allowed 'General case' 0 C--O 1.234 0.285 0 C-N-CA 128.312 2.645 . . . . 0.0 113.235 -169.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 22.5 ttpp -50.82 -43.43 58.95 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.304 1.042 . . . . 0.0 110.589 -174.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -64.68 -35.61 81.6 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-O 118.723 -0.656 . . . . 0.0 111.602 -177.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -68.79 -51.38 41.57 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 119.502 1.047 . . . . 0.0 109.43 176.063 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -57.52 -42.35 82.68 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 120.996 0.427 . . . . 0.0 109.965 -178.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 55.9 tt0 -55.88 -65.66 0.56 Allowed 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 123.998 0.919 . . . . 0.0 109.233 169.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 4.9 mt -37.66 -60.65 0.69 Allowed 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 124.864 1.265 . . . . 0.0 112.003 179.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 18.3 tt -61.12 -48.53 88.59 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 -176.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 -56.5 -50.47 71.69 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.807 0.73 . . . . 0.0 112.063 179.284 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -70.35 -50.98 33.36 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.231 0.612 . . . . 0.0 110.695 -174.123 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -96.38 -17.83 20.36 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 -167.309 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 45.3 mt . . . . . 0 CA--C 1.526 0.039 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 169.883 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 . . . . . 0 C--O 1.225 -0.227 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.93 -60.24 0.17 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 126.108 1.763 . . . . 0.0 113.909 -179.317 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -63.57 -44.19 94.82 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.553 0.741 . . . . 0.0 110.843 -174.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.4 mp -62.06 -52.38 61.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 -177.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 75.6 t -53.86 -53.6 25.85 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 C-N-CA 123.961 0.905 . . . . 0.0 109.319 177.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -47.28 -52.5 16.01 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 118.698 0.681 . . . . 0.0 111.81 178.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 16.7 mt -50.57 -39.32 49.18 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 119.269 -0.396 . . . . 0.0 111.923 178.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 8.7 mmt -81.0 -64.72 1.13 Allowed 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 118.458 0.572 . . . . 0.0 109.737 178.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -34.82 -43.8 0.2 Allowed 'General case' 0 CA--C 1.523 -0.067 0 C-N-CA 128.046 2.538 . . . . 0.0 112.069 178.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -37.41 -50.95 1.1 Allowed 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.61 1.164 . . . . 0.0 112.577 176.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.8 pp -60.49 -33.13 72.16 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -173.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -83.54 -45.65 13.32 Favored 'General case' 0 N--CA 1.456 -0.125 0 C-N-CA 123.516 0.727 . . . . 0.0 109.746 176.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 52.8 ttt-85 -58.16 -37.14 74.11 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 122.178 -0.326 . . . . 0.0 110.955 -176.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 . . . . . 0 CA--C 1.537 0.458 0 O-C-N 121.478 -0.764 . . . . 0.0 112.357 177.766 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 . . . . . 0 N--CA 1.452 -0.351 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 28.4 m -79.58 136.08 24.31 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 N-CA-C 107.829 -1.175 . . . . 0.0 107.829 169.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 1.1 p30 -80.65 171.47 14.98 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.774 0.321 . . . . 0.0 111.186 176.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 55.9 t80 -38.12 -61.92 0.62 Allowed 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.401 1.08 . . . . 0.0 112.97 174.023 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 10.2 tp-100 -63.98 -32.52 74.09 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 120.391 1.45 . . . . 0.0 111.694 -175.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -64.52 -41.72 96.21 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 119.623 1.101 . . . . 0.0 110.162 175.15 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -57.95 -48.67 79.26 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.794 -0.566 . . . . 0.0 109.796 171.572 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 19.7 mm -60.83 -27.77 41.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 O-C-N 121.532 -0.73 . . . . 0.0 110.745 176.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 42.5 m -73.34 -38.69 65.67 Favored 'General case' 0 C--O 1.226 -0.181 0 O-C-N 121.076 -1.015 . . . . 0.0 110.171 172.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 36.6 t80 -54.33 -54.76 36.01 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 171.175 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 32.8 mt -59.9 -47.65 84.88 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 177.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.69 -39.83 97.93 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 111.021 -0.831 . . . . 0.0 111.021 -174.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.69 -47.85 57.74 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 123.882 0.873 . . . . 0.0 110.22 176.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -47.58 -53.74 13.72 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 123.933 0.893 . . . . 0.0 109.565 173.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -55.12 -56.31 21.25 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 124.259 1.024 . . . . 0.0 110.365 174.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 51.5 ttm -50.55 -42.95 55.96 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.516 0.598 . . . . 0.0 111.763 -178.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 42.8 mt -67.88 -58.39 6.24 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.442 0 CA-C-O 118.385 -0.817 . . . . 0.0 110.644 -179.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.364 1.0 OUTLIER -77.42 -38.39 49.79 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 119.94 1.246 . . . . 0.0 113.385 -174.674 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -78.75 64.86 3.84 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 170.295 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 60.0 mt-10 -46.91 -31.29 3.03 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 125.702 1.601 . . . . 0.0 112.802 -174.082 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -45.48 -36.92 4.79 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.06 0.944 . . . . 0.0 112.767 175.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 83.8 mt . . . . . 0 CA--C 1.533 0.299 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 178.267 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.192 0 CA-C-O 120.583 0.23 . . . . 0.0 111.214 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 2.7 m -54.51 161.71 1.99 Allowed Pre-proline 0 CA--C 1.538 0.518 0 C-N-CA 123.829 0.852 . . . . 0.0 111.193 173.213 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_exo -45.57 -49.08 11.08 Favored 'Trans proline' 0 N--CA 1.46 -0.453 0 C-N-CA 123.519 2.813 . . . . 0.0 113.573 -179.39 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.8 mt -55.62 -52.93 62.12 Favored 'General case' 0 C--O 1.226 -0.168 0 N-CA-C 111.769 0.285 . . . . 0.0 111.769 174.328 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -60.24 -41.44 93.14 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 -175.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.0 tp-100 -60.98 -51.08 70.76 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.57 0.748 . . . . 0.0 110.493 176.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.99 -45.81 93.31 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.338 0.655 . . . . 0.0 111.146 -178.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 67.2 mt -53.59 -52.16 36.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 170.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.69 -47.74 23.88 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 125.369 1.462 . . . . 0.0 111.601 175.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 mt -55.98 -54.59 42.96 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 117.726 0.763 . . . . 0.0 110.995 174.443 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.99 -43.93 91.53 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 118.87 0.759 . . . . 0.0 111.558 -179.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 96.2 mt -58.05 -49.29 81.9 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 123.007 0.523 . . . . 0.0 110.173 173.546 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.75 -51.54 54.4 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 110.102 -1.199 . . . . 0.0 110.102 -178.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 8.2 mm -54.81 -49.35 70.05 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 123.273 0.629 . . . . 0.0 109.745 175.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -53.48 -55.67 23.36 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 121.479 0.657 . . . . 0.0 110.985 178.077 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 74.2 t60 -64.79 -32.39 74.05 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.346 -175.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -53.11 -49.65 66.07 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.882 0.764 . . . . 0.0 110.712 176.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -89.96 -36.04 15.21 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 122.323 -0.236 . . . . 0.0 111.321 -175.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.3 t . . . . . 0 CA--C 1.538 0.487 0 O-C-N 121.775 -0.578 . . . . 0.0 110.641 173.555 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.206 0 N-CA-C 105.694 -1.965 . . . . 0.0 105.694 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -160.01 174.82 13.78 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 119.008 0.822 . . . . 0.0 110.661 -176.79 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 59.6 p -124.57 174.38 7.86 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 118.808 0.731 . . . . 0.0 112.579 -170.025 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -27.39 -53.47 0.08 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 128.348 2.659 . . . . 0.0 114.016 169.664 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.07 -54.77 40.98 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.805 0.842 . . . . 0.0 109.713 179.724 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 -66.11 -34.34 77.83 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 118.642 -0.694 . . . . 0.0 110.527 -177.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 60.2 mt -65.13 -50.06 67.51 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.317 0.962 . . . . 0.0 110.999 177.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 40.7 mttp -57.19 -49.16 76.83 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 174.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -53.09 -54.73 31.26 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.644 0.778 . . . . 0.0 110.302 177.006 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.6 mt -48.42 -65.29 0.59 Allowed 'General case' 0 CA--C 1.52 -0.196 0 C-N-CA 126.099 1.759 . . . . 0.0 110.171 177.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 16.9 tt -59.89 -44.76 95.03 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.275 0 N-CA-C 109.543 -0.539 . . . . 0.0 109.543 -171.442 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -60.16 -53.51 56.93 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 179.364 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -67.82 -49.19 63.58 Favored 'General case' 0 C--O 1.227 -0.083 0 O-C-N 121.825 -0.547 . . . . 0.0 109.576 -174.133 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -74.63 -65.05 0.91 Allowed 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -175.767 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 89.3 mt . . . . . 0 N--CA 1.455 -0.2 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 -178.068 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 . . . . . 0 CA--C 1.531 0.213 0 N-CA-C 114.773 1.398 . . . . 0.0 114.773 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.86 -59.56 0.17 Allowed 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.796 1.639 . . . . 0.0 114.66 -178.237 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 17.6 tt0 -65.57 -40.27 92.58 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-O 121.13 0.491 . . . . 0.0 111.214 -174.265 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 2.2 mp -63.83 -51.86 64.36 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 69.2 t -55.13 -43.7 71.34 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 C-N-CA 124.401 1.081 . . . . 0.0 110.348 178.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.34 -54.41 45.78 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 119.205 0.911 . . . . 0.0 110.454 173.89 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 57.5 mt -54.18 -40.02 67.15 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 119.267 -0.397 . . . . 0.0 111.2 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 25.3 mmt -68.62 -65.01 0.75 Allowed 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.549 0.613 . . . . 0.0 109.711 175.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -40.69 -40.46 1.31 Allowed 'General case' 0 N--CA 1.462 0.171 0 C-N-CA 128.077 2.551 . . . . 0.0 111.886 -177.572 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -38.43 -48.55 1.38 Allowed 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 124.479 1.112 . . . . 0.0 111.876 175.284 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -61.33 -38.29 86.37 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 118.393 0.542 . . . . 0.0 111.838 -176.551 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -76.15 -51.19 12.68 Favored 'General case' 0 N--CA 1.457 -0.106 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 16.9 ttm180 . . . . . 0 N--CA 1.455 -0.208 0 C-N-CA 123.571 0.748 . . . . 0.0 109.926 177.215 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 . . . . . 0 CA--C 1.53 0.186 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.4 m -137.38 149.65 25.79 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 C-N-CA 126.044 1.738 . . . . 0.0 108.079 174.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -89.49 175.71 7.19 Favored 'General case' 0 C--N 1.339 0.142 0 C-N-CA 124.285 1.034 . . . . 0.0 111.108 176.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -39.46 -64.74 0.44 Allowed 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 125.275 1.43 . . . . 0.0 112.967 174.483 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 11.0 tp-100 -65.03 -32.22 73.83 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 120.242 1.383 . . . . 0.0 111.807 -172.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -65.22 -44.47 88.15 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 119.033 0.833 . . . . 0.0 110.419 175.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -55.92 -54.31 46.28 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 172.279 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 20.7 mm -52.06 -46.37 42.63 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.312 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 178.419 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 92.9 m -59.35 -27.8 66.26 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 123.464 0.706 . . . . 0.0 111.795 179.084 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 11.4 t80 -59.69 -52.13 66.84 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 119.464 1.029 . . . . 0.0 108.436 172.166 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 56.2 mt -67.26 -40.05 86.15 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.853 0.861 . . . . 0.0 111.699 -179.538 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.51 -45.12 69.38 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.135 -1.186 . . . . 0.0 110.135 -178.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.02 -48.58 81.13 Favored 'General case' 0 N--CA 1.451 -0.387 0 O-C-N 122.279 -0.541 . . . . 0.0 109.796 173.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 22.5 tp -50.44 -57.03 8.97 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.407 0.622 . . . . 0.0 109.807 176.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.1 -55.04 16.57 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 124.56 1.144 . . . . 0.0 110.247 177.294 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 7.7 ttp -59.82 -45.07 93.53 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 122.925 0.49 . . . . 0.0 111.516 -175.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 93.0 mt -64.63 -52.94 48.4 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 CA-C-O 117.995 -1.002 . . . . 0.0 110.281 -177.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.445 0.0 OUTLIER -79.3 -34.06 42.73 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 120.034 1.288 . . . . 0.0 113.887 -176.121 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -80.1 72.93 6.92 Favored 'General case' 0 N--CA 1.462 0.164 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 169.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -47.79 -30.48 4.01 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.956 1.302 . . . . 0.0 113.097 -171.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -38.79 -47.02 1.34 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.959 1.304 . . . . 0.0 112.39 169.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.4 mt . . . . . 0 CA--C 1.534 0.343 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -177.241 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.277 0 CA-C-O 121.249 0.547 . . . . 0.0 110.378 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 2.5 m -59.63 166.41 3.33 Favored Pre-proline 0 CA--C 1.539 0.549 0 C-N-CA 125.134 1.374 . . . . 0.0 111.202 178.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_exo -45.75 -47.26 14.05 Favored 'Trans proline' 0 N--CA 1.459 -0.5 0 C-N-CA 123.257 2.638 . . . . 0.0 112.927 177.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 6.2 mt -56.67 -49.23 75.69 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 119.329 -0.367 . . . . 0.0 111.514 174.249 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -58.21 -46.74 85.31 Favored 'General case' 0 N--CA 1.457 -0.124 0 CA-C-N 118.488 0.585 . . . . 0.0 109.853 -178.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 -57.54 -51.0 71.25 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 122.759 0.424 . . . . 0.0 110.575 177.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.5 -45.7 82.55 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.49 0.716 . . . . 0.0 111.867 -175.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 81.7 mt -55.88 -50.08 70.97 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 172.002 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.37 -50.39 17.84 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 124.886 1.231 . . . . 0.0 111.5 173.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.1 mt -54.24 -57.59 10.59 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 117.474 0.637 . . . . 0.0 110.702 174.223 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 9.9 mp -57.42 -43.44 83.82 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 119.391 0.996 . . . . 0.0 112.032 -177.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 85.8 mt -56.97 -58.03 7.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 C-N-CA 123.171 0.588 . . . . 0.0 110.12 173.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.25 -49.5 67.86 Favored Glycine 0 CA--C 1.524 0.605 0 N-CA-C 110.553 -1.019 . . . . 0.0 110.553 -175.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.3 mm -49.68 -50.99 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 C-N-CA 124.139 0.976 . . . . 0.0 109.935 173.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 56.4 t80 -57.46 -58.94 6.1 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 121.042 0.449 . . . . 0.0 110.008 178.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 7.1 t-80 -51.55 -36.98 47.43 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.051 0.94 . . . . 0.0 111.626 -176.513 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -51.56 -34.04 34.97 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.298 1.039 . . . . 0.0 112.474 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -111.61 -47.41 3.16 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 118.6 0.636 . . . . 0.0 110.688 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.455 -0.203 0 C-N-CA 123.266 0.626 . . . . 0.0 111.963 -176.398 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.539 0.536 0 N-CA-C 114.109 1.152 . . . . 0.0 114.109 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -138.85 151.91 47.38 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.078 1.351 . . . . 0.0 109.474 -170.201 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -156.09 166.38 33.62 Favored 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 123.26 0.624 . . . . 0.0 110.779 174.031 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 67.9 m -111.76 174.68 5.76 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.145 1.378 . . . . 0.0 112.818 -176.197 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -37.81 -55.38 1.19 Allowed 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 126.913 2.085 . . . . 0.0 114.545 -177.683 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -53.56 -48.51 69.08 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 -176.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -61.14 -38.65 87.16 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 123.041 0.536 . . . . 0.0 111.324 179.133 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 85.0 mt -63.27 -49.33 74.48 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 119.214 0.916 . . . . 0.0 111.038 175.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -57.56 -47.17 82.79 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 177.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -58.17 -47.41 83.49 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-O 119.024 -0.512 . . . . 0.0 110.791 175.232 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 8.9 mt -50.76 -53.58 30.56 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 119.655 1.116 . . . . 0.0 110.176 178.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 35.9 mt -56.78 -60.34 2.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.212 175.558 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 21.1 tt0 -53.07 -48.98 67.3 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.621 -0.674 . . . . 0.0 112.496 -173.476 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 9.5 mmpt? -79.53 -48.97 12.96 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 125.564 1.546 . . . . 0.0 110.551 -171.178 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 28.2 mm-40 -101.89 -12.42 18.26 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 -168.435 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 57.2 mt . . . . . 0 C--O 1.231 0.102 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 169.559 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 18.3 p-10 . . . . . 0 N--CA 1.463 0.189 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.84 -63.57 0.13 Allowed 'General case' 0 C--O 1.226 -0.142 0 C-N-CA 126.198 1.799 . . . . 0.0 114.133 -174.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -66.17 -37.54 85.89 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 122.747 0.419 . . . . 0.0 111.32 -172.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.4 mp -62.28 -52.76 56.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 N-CA-C 106.076 -1.824 . . . . 0.0 106.076 177.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 71.9 t -54.04 -40.87 47.68 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 C-N-CA 124.23 1.012 . . . . 0.0 110.41 176.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 12.8 mmmt -60.94 -51.22 70.21 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 120.187 1.358 . . . . 0.0 110.484 175.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 76.3 mt -56.96 -36.41 70.26 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 119.148 -0.454 . . . . 0.0 110.906 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 25.2 mmt -70.26 -62.49 1.37 Allowed 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 118.739 0.699 . . . . 0.0 109.808 173.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -46.61 -30.47 2.31 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 128.132 2.573 . . . . 0.0 112.405 -176.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -38.29 -48.17 1.28 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.508 1.123 . . . . 0.0 111.268 169.181 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.9 pp -58.52 -34.32 70.83 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 121.144 -0.972 . . . . 0.0 112.167 -178.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -78.42 -55.95 4.82 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 178.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 16.5 mmt180 -42.11 -50.35 4.75 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 124.972 1.309 . . . . 0.0 110.646 176.371 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 25.5 m120 . . . . . 0 N--CA 1.449 -0.485 0 C-N-CA 123.971 0.908 . . . . 0.0 111.849 -171.456 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 . . . . . 0 N--CA 1.452 -0.348 0 CA-C-O 120.643 0.259 . . . . 0.0 111.309 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 34.9 m -132.58 147.6 31.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 N-CA-C 105.618 -1.993 . . . . 0.0 105.618 165.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 20.2 p30 -89.24 171.6 9.67 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 123.556 0.742 . . . . 0.0 110.884 176.746 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -39.97 -60.85 0.95 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.568 1.147 . . . . 0.0 113.16 175.186 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -64.56 -35.99 82.78 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 120.314 1.416 . . . . 0.0 111.362 -174.167 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.77 -40.27 96.27 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.561 -0.712 . . . . 0.0 110.578 175.194 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -57.2 -49.68 75.25 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 118.571 0.623 . . . . 0.0 109.964 169.653 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 24.6 mm -58.62 -28.14 36.05 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 O-C-N 121.384 -0.822 . . . . 0.0 110.709 176.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 30.1 m -80.25 -23.48 40.79 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.231 1.012 . . . . 0.0 111.786 173.366 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -67.56 -53.48 28.0 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 107.673 -1.232 . . . . 0.0 107.673 169.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 40.9 mt -57.65 -41.65 81.91 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 120.908 0.385 . . . . 0.0 110.668 171.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.76 -53.1 46.53 Favored Glycine 0 CA--C 1.523 0.577 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 179.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.75 -47.31 85.8 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 122.83 0.452 . . . . 0.0 110.641 178.218 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 11.3 tp -48.06 -60.54 2.54 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.978 0.894 . . . . 0.0 110.082 175.155 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.85 -56.64 12.78 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 125.31 1.444 . . . . 0.0 110.294 -179.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 56.6 ttm -56.26 -43.42 78.71 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.737 0.815 . . . . 0.0 110.989 -178.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 96.4 mt -67.9 -55.74 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-O 118.415 -0.802 . . . . 0.0 109.533 -175.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.4 0.4 OUTLIER -73.13 -33.63 65.64 Favored 'General case' 0 C--N 1.344 0.356 0 C-N-CA 118.325 -1.35 . . . . 0.0 112.803 -175.982 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -81.14 64.98 6.1 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 169.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -42.22 -37.96 1.63 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.138 1.375 . . . . 0.0 112.747 -176.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.69 -54.0 0.44 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 126.093 1.757 . . . . 0.0 112.65 169.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 61.7 mt . . . . . 0 CA--C 1.532 0.284 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -173.285 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.137 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.4 m -56.01 163.79 2.07 Favored Pre-proline 0 CA--C 1.54 0.593 0 C-N-CA 124.204 1.002 . . . . 0.0 111.352 177.049 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -46.62 -49.02 12.71 Favored 'Trans proline' 0 N--CA 1.459 -0.528 0 C-N-CA 123.255 2.637 . . . . 0.0 112.831 178.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.2 mt -58.64 -46.39 87.22 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-O 119.193 -0.432 . . . . 0.0 111.543 175.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -56.97 -48.18 79.0 Favored 'General case' 0 C--O 1.227 -0.131 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 -179.025 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.3 tp60 -62.81 -44.44 96.14 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.275 179.146 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.4 -46.17 81.08 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 121.355 0.598 . . . . 0.0 111.328 -178.181 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 72.4 mt -54.55 -50.86 55.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 170.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.51 -48.98 16.48 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 124.646 1.117 . . . . 0.0 111.729 173.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 mt -55.36 -55.34 32.71 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 117.767 0.784 . . . . 0.0 110.945 174.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -58.91 -45.2 90.9 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 119.012 0.824 . . . . 0.0 111.839 -178.04 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 90.5 mt -59.5 -50.98 77.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 C-N-CA 122.857 0.463 . . . . 0.0 110.354 175.073 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -53.59 -54.07 32.3 Favored Glycine 0 CA--C 1.523 0.539 0 N-CA-C 109.763 -1.335 . . . . 0.0 109.763 -179.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 6.8 mm -50.53 -51.7 18.24 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 C-N-CA 124.079 0.952 . . . . 0.0 110.12 174.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -51.51 -57.25 9.57 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 118.022 0.374 . . . . 0.0 110.594 178.454 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -70.3 -21.7 62.91 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 -174.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.8 ttpp -57.93 -18.57 24.09 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 119.034 -0.508 . . . . 0.0 111.342 169.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -115.92 -67.72 0.97 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.743 0.817 . . . . 0.0 110.273 171.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 30.9 p . . . . . 0 N--CA 1.469 0.476 0 CA-C-O 121.714 0.769 . . . . 0.0 111.158 -173.997 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.3 p . . . . . 0 N--CA 1.449 -0.478 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.7 pp -160.2 -173.86 4.24 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 169.384 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 77.8 p -129.95 172.84 11.28 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 119.697 1.135 . . . . 0.0 112.568 -179.582 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.7 ptmm? -31.69 -51.06 0.21 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 126.107 1.763 . . . . 0.0 113.512 169.491 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.7 ttpt -60.87 -47.53 85.98 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -177.241 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.0 mp0 -66.55 -35.44 80.23 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 118.428 -0.796 . . . . 0.0 110.559 179.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 73.7 mt -61.52 -51.38 68.85 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.779 1.172 . . . . 0.0 111.032 174.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.0 mtpp -60.11 -45.12 94.03 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 120.841 0.353 . . . . 0.0 110.279 179.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -54.52 -54.93 34.58 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.112 0.965 . . . . 0.0 110.521 173.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.0 mt -49.02 -61.19 2.2 Favored 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 125.382 1.473 . . . . 0.0 110.033 178.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 20.2 tt -59.71 -48.74 86.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 C-N-CA 119.872 -0.731 . . . . 0.0 109.724 -176.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 -54.88 -50.11 69.54 Favored 'General case' 0 CA--C 1.539 0.528 0 O-C-N 121.88 -0.512 . . . . 0.0 112.208 -178.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.7 -54.21 7.32 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 121.908 -0.495 . . . . 0.0 110.714 -176.862 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 49.8 mm-40 -82.4 -21.81 35.64 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 -167.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 23.0 mt . . . . . 0 C--O 1.227 -0.086 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 174.437 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 . . . . . 0 N--CA 1.462 0.135 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.37 -60.91 0.14 Allowed 'General case' 0 C--O 1.226 -0.177 0 C-N-CA 125.874 1.67 . . . . 0.0 113.313 -176.331 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -64.56 -38.09 89.82 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -173.316 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 1.2 mp -61.64 -54.97 27.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 N-CA-C 106.159 -1.793 . . . . 0.0 106.159 176.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 79.1 t -51.49 -49.62 32.22 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.079 -178.298 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 6.4 mmmm -51.86 -47.61 64.37 Favored 'General case' 0 C--N 1.339 0.111 0 CA-C-N 119.59 1.086 . . . . 0.0 111.753 -176.567 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 32.9 mt -57.33 -35.61 70.1 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 119.283 -0.389 . . . . 0.0 111.543 -178.011 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.28 -62.87 1.55 Allowed 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 176.128 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -40.57 -40.36 1.24 Allowed 'General case' 0 CA--C 1.523 -0.094 0 C-N-CA 127.528 2.331 . . . . 0.0 111.877 -179.351 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -38.52 -47.57 1.3 Allowed 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.811 1.244 . . . . 0.0 112.009 175.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -57.6 -51.89 67.65 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 118.124 0.42 . . . . 0.0 110.713 -178.44 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -74.44 -31.38 62.26 Favored 'General case' 0 C--O 1.224 -0.262 0 C-N-CA 123.231 0.613 . . . . 0.0 111.383 -176.215 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.5 ttm180 . . . . . 0 N--CA 1.452 -0.369 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 173.315 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 . . . . . 0 CA--C 1.533 0.315 0 CA-C-O 120.822 0.344 . . . . 0.0 110.735 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 4.2 m -143.93 159.79 16.03 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 127.218 2.207 . . . . 0.0 107.87 174.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -101.04 170.92 7.95 Favored 'General case' 0 N--CA 1.462 0.157 0 C-N-CA 125.086 1.354 . . . . 0.0 110.964 175.812 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 73.9 t80 -35.12 -63.42 0.33 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.685 1.194 . . . . 0.0 112.945 171.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 28.9 tp60 -67.03 -29.04 68.74 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 119.633 1.106 . . . . 0.0 111.81 -171.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -65.72 -43.23 89.73 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.14 -0.975 . . . . 0.0 109.845 172.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -54.43 -49.29 70.33 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.985 -0.447 . . . . 0.0 109.91 170.611 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.8 mm -58.72 -33.53 49.29 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 O-C-N 121.6 -0.688 . . . . 0.0 110.732 175.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 32.3 m -70.52 -30.27 66.99 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.07 -1.019 . . . . 0.0 111.04 174.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -61.03 -55.45 32.65 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 121.096 -1.003 . . . . 0.0 109.169 170.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 44.3 mt -62.36 -40.25 95.8 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.118 0.485 . . . . 0.0 111.535 179.19 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.35 -43.69 96.49 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 110.643 -0.983 . . . . 0.0 110.643 179.617 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.39 -47.8 80.5 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 117.497 0.648 . . . . 0.0 110.444 175.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 20.3 tp -48.61 -58.98 3.89 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 121.402 0.62 . . . . 0.0 110.257 172.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -49.77 -54.18 20.58 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 124.381 1.073 . . . . 0.0 110.496 179.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 46.9 ttm -57.84 -49.78 75.51 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 123.809 0.844 . . . . 0.0 111.091 -178.316 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 67.0 mt -63.35 -49.56 82.37 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 CA-C-O 117.942 -1.028 . . . . 0.0 109.932 -174.13 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.451 0.1 OUTLIER -79.46 -37.66 36.4 Favored 'General case' 0 C--N 1.347 0.488 0 CA-C-N 119.733 1.151 . . . . 0.0 113.837 -178.258 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -80.72 75.12 7.64 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 107.691 -1.225 . . . . 0.0 107.691 171.043 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -47.66 -32.45 5.67 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.627 1.171 . . . . 0.0 112.684 -175.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -40.87 -38.87 1.02 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.673 1.189 . . . . 0.0 113.171 171.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 43.7 mt . . . . . 0 CA--C 1.537 0.462 0 C-N-CA 124.939 1.296 . . . . 0.0 113.828 -173.828 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.247 0 CA-C-O 120.902 0.382 . . . . 0.0 110.101 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -53.83 159.99 2.38 Favored Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 124.622 1.169 . . . . 0.0 111.248 176.74 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -47.52 -49.62 12.94 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 123.305 2.67 . . . . 0.0 112.806 179.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.2 mt -58.41 -43.88 88.79 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 119.094 -0.479 . . . . 0.0 111.788 174.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -62.86 -42.06 99.61 Favored 'General case' 0 C--O 1.226 -0.143 0 CA-C-N 119.045 0.838 . . . . 0.0 109.489 -177.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 12.8 tp60 -61.69 -46.75 88.37 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 122.39 0.276 . . . . 0.0 110.853 175.109 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.28 -46.8 82.09 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.645 0.736 . . . . 0.0 111.275 -177.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 74.8 mt -55.74 -50.92 64.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 171.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -48.49 -45.89 29.43 Favored Glycine 0 CA--C 1.527 0.787 0 C-N-CA 125.031 1.301 . . . . 0.0 111.468 175.372 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.8 mt -56.27 -57.45 12.18 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 117.613 0.707 . . . . 0.0 110.409 173.284 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -57.12 -43.4 82.32 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 119.371 0.987 . . . . 0.0 112.122 -178.225 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 97.2 mt -61.2 -54.08 40.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 123.151 0.58 . . . . 0.0 110.679 175.495 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.99 -51.23 55.16 Favored Glycine 0 CA--C 1.522 0.494 0 N-CA-C 109.666 -1.374 . . . . 0.0 109.666 -177.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 8.5 mm -48.04 -54.7 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 C-N-CA 124.279 1.032 . . . . 0.0 110.277 173.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -53.29 -62.15 1.84 Allowed 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 121.347 0.594 . . . . 0.0 110.257 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 54.7 t60 -72.63 -12.91 61.24 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 118.971 -0.538 . . . . 0.0 112.393 -170.812 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -54.96 -44.48 74.4 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.423 1.01 . . . . 0.0 108.778 169.093 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -94.15 73.07 3.99 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 104.9 -2.259 . . . . 0.0 104.9 171.122 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 85.1 p . . . . . 0 CA--C 1.531 0.225 0 C-N-CA 127.227 2.211 . . . . 0.0 114.376 -167.678 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 6.4 p-80 . . . . . 0 CA--C 1.54 0.578 0 N-CA-C 111.58 0.215 . . . . 0.0 111.58 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 71.6 p -134.43 145.03 48.5 Favored 'General case' 0 C--O 1.227 -0.089 0 C-N-CA 124.921 1.288 . . . . 0.0 108.246 175.643 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -156.57 163.03 39.84 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-N 119.323 0.965 . . . . 0.0 110.69 -178.092 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 29.9 t -120.99 -168.65 1.7 Allowed 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.635 0.731 . . . . 0.0 110.944 -176.197 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 10.3 pttm -46.99 -50.98 18.22 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 126.893 2.077 . . . . 0.0 113.131 -171.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -55.48 -52.13 64.66 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 120.762 0.315 . . . . 0.0 110.294 -179.132 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -67.04 -35.66 80.37 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 118.436 -0.792 . . . . 0.0 111.8 -179.456 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 30.0 mt -64.03 -52.3 60.14 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 119.966 1.257 . . . . 0.0 111.149 175.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 90.4 mttt -56.38 -43.83 79.6 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 122.707 0.403 . . . . 0.0 110.044 177.317 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 65.7 tt0 -54.09 -66.45 0.39 Allowed 'General case' 0 C--O 1.223 -0.334 0 CA-C-O 118.895 -0.574 . . . . 0.0 109.523 171.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 3.8 mt -37.54 -60.09 0.72 Allowed 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 125.364 1.465 . . . . 0.0 111.565 179.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 14.3 tt -62.55 -45.2 99.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.265 -176.094 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 -57.34 -52.96 63.22 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 121.343 -0.848 . . . . 0.0 111.731 177.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 11.4 mmpt? -66.76 -49.29 66.4 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.059 0.544 . . . . 0.0 110.497 -174.562 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 70.1 mm-40 -98.06 -16.65 19.51 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 115.06 1.504 . . . . 0.0 115.06 -166.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 13.5 mt . . . . . 0 CA--C 1.523 -0.088 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 171.894 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 . . . . . 0 C--O 1.225 -0.222 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.64 -56.25 0.16 Allowed 'General case' 0 CA--C 1.527 0.092 0 C-N-CA 126.118 1.767 . . . . 0.0 114.455 -177.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -67.45 -39.54 85.37 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 120.912 0.387 . . . . 0.0 111.148 -174.436 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.5 mp -61.68 -51.4 73.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 176.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 76.9 t -57.34 -42.4 80.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 C-N-CA 123.938 0.895 . . . . 0.0 110.475 -179.417 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.76 -55.21 37.79 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 119.433 1.015 . . . . 0.0 110.443 173.089 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 49.0 mt -53.35 -37.96 62.84 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 122.489 0.316 . . . . 0.0 111.544 -179.55 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.72 -65.56 0.81 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.236 0.471 . . . . 0.0 109.961 175.721 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -40.32 -39.88 1.05 Allowed 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 127.489 2.316 . . . . 0.0 111.991 -177.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -37.04 -51.34 0.94 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.172 1.389 . . . . 0.0 111.816 172.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -58.75 -35.64 73.05 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 121.43 -0.794 . . . . 0.0 112.232 -176.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -80.75 -49.57 10.98 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 123.141 0.577 . . . . 0.0 109.629 179.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 14.8 ttm180 -50.89 -46.72 60.64 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.617 0.767 . . . . 0.0 110.164 178.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 34.6 m120 . . . . . 0 N--CA 1.455 -0.214 0 C-N-CA 123.257 0.623 . . . . 0.0 112.37 -179.104 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 50.0 mm-40 . . . . . 0 N--CA 1.45 -0.473 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 32.7 m -87.13 148.52 4.56 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 N-CA-C 107.483 -1.302 . . . . 0.0 107.483 167.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 15.5 p-10 -91.18 -176.68 4.66 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 123.94 0.896 . . . . 0.0 111.403 177.341 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -49.84 -62.09 1.76 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.853 0.861 . . . . 0.0 112.293 177.256 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 41.1 tp60 -60.4 -37.25 80.23 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 119.299 0.954 . . . . 0.0 111.17 -174.064 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -62.66 -46.07 89.9 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.711 -0.618 . . . . 0.0 110.705 175.753 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -55.15 -49.81 70.89 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.846 -0.534 . . . . 0.0 110.148 171.59 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 26.8 mm -56.98 -28.48 28.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 O-C-N 121.799 -0.563 . . . . 0.0 110.464 175.425 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 27.8 m -80.96 -24.48 38.07 Favored 'General case' 0 CA--C 1.529 0.171 0 O-C-N 121.301 -0.874 . . . . 0.0 112.986 173.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -62.9 -52.74 61.9 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 107.117 -1.438 . . . . 0.0 107.117 167.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 48.9 mt -62.22 -40.9 97.65 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 120.888 0.375 . . . . 0.0 111.726 175.295 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -60.82 -49.53 77.58 Favored Glycine 0 CA--C 1.521 0.428 0 N-CA-C 110.53 -1.028 . . . . 0.0 110.53 -179.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.49 -47.44 85.66 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.155 0.582 . . . . 0.0 110.026 175.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 19.5 tp -49.59 -57.22 7.54 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.455 0.645 . . . . 0.0 109.853 175.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.64 -56.47 13.41 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 124.71 1.204 . . . . 0.0 110.55 178.724 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 55.5 ttm -54.56 -46.97 73.75 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.172 0.989 . . . . 0.0 111.177 -178.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.1 mt -66.52 -52.86 41.57 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.301 0 CA-C-O 117.922 -1.037 . . . . 0.0 110.399 -175.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.436 0.0 OUTLIER -80.46 -33.59 36.59 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 120.027 1.285 . . . . 0.0 114.141 -176.611 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 22.6 m-80 -81.33 70.03 8.09 Favored 'General case' 0 CA--C 1.523 -0.088 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 170.166 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -42.82 -38.25 2.08 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 126.024 1.73 . . . . 0.0 111.699 -176.134 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -34.02 -47.68 0.28 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 126.551 1.94 . . . . 0.0 113.343 170.62 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 64.5 mt . . . . . 0 CA--C 1.531 0.23 0 C-N-CA 123.126 0.571 . . . . 0.0 112.443 -177.382 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.223 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.1 m -51.84 158.19 1.75 Allowed Pre-proline 0 CA--C 1.54 0.558 0 C-N-CA 124.149 0.98 . . . . 0.0 110.802 171.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -48.47 -48.9 15.81 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 122.944 2.429 . . . . 0.0 112.752 -179.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.9 mt -59.95 -44.91 94.11 Favored 'General case' 0 C--O 1.224 -0.251 0 CA-C-O 119.299 -0.381 . . . . 0.0 111.328 175.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -58.89 -46.82 86.94 Favored 'General case' 0 CA--C 1.528 0.12 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 -178.143 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -57.68 -52.4 65.58 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.383 0.673 . . . . 0.0 110.743 175.76 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.95 -46.2 88.88 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.407 0.622 . . . . 0.0 111.783 -175.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 71.2 mt -54.65 -51.88 46.69 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 171.282 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.55 -48.31 17.06 Favored Glycine 0 CA--C 1.527 0.814 0 C-N-CA 124.725 1.155 . . . . 0.0 111.804 174.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 mt -55.74 -56.42 20.65 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 117.613 0.706 . . . . 0.0 111.078 174.365 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 mp -58.3 -44.15 88.43 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 118.979 0.809 . . . . 0.0 111.696 -178.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 83.3 mt -55.81 -55.14 19.43 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.185 0 C-N-CA 123.316 0.646 . . . . 0.0 109.975 173.283 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.06 -50.03 56.89 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 110.541 -1.024 . . . . 0.0 110.541 -177.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 11.7 mm -53.03 -49.2 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 C-N-CA 123.371 0.668 . . . . 0.0 110.271 175.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -56.4 -62.96 1.36 Allowed 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 121.293 0.568 . . . . 0.0 109.622 177.05 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -51.82 -39.68 59.19 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.8 1.24 . . . . 0.0 111.689 -174.049 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.5 tttp -48.97 -39.42 26.49 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.079 0.951 . . . . 0.0 111.441 178.01 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -100.01 -59.85 1.64 Allowed 'General case' 0 C--O 1.234 0.261 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.6 m . . . . . 0 N--CA 1.453 -0.281 0 C-N-CA 124.049 0.94 . . . . 0.0 111.117 -175.662 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 60.3 p . . . . . 0 CA--C 1.538 0.484 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -145.64 168.84 19.69 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 123.236 0.614 . . . . 0.0 110.531 176.017 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 72.8 m -111.1 177.05 4.78 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.187 1.395 . . . . 0.0 113.73 -174.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.5 ptpt -41.92 -53.7 3.72 Favored 'General case' 0 C--N 1.339 0.146 0 C-N-CA 126.602 1.961 . . . . 0.0 114.594 -176.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 23.5 ttmm -54.75 -50.09 69.26 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 -177.629 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -58.56 -44.14 89.61 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-O 118.693 -0.67 . . . . 0.0 111.098 177.515 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 90.0 mt -59.02 -51.2 71.09 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 119.17 0.896 . . . . 0.0 111.52 176.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 54.5 mtmt -59.01 -47.66 84.39 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 -179.022 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.3 -54.15 48.84 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-O 119.28 -0.39 . . . . 0.0 110.836 174.105 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.6 mt -44.77 -64.4 0.71 Allowed 'General case' 0 CA--C 1.522 -0.109 0 C-N-CA 124.25 1.02 . . . . 0.0 110.425 177.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 18.3 tt -60.24 -49.62 83.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 120.174 -0.61 . . . . 0.0 109.989 -175.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -55.93 -49.2 74.16 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.579 0.752 . . . . 0.0 112.332 -176.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.46 -54.4 7.09 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 -176.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -73.8 -29.98 62.47 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 118.302 -0.856 . . . . 0.0 112.72 -168.322 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 59.7 mt . . . . . 0 C--N 1.339 0.126 0 N-CA-C 107.221 -1.399 . . . . 0.0 107.221 167.847 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.8 t70 . . . . . 0 C--O 1.227 -0.128 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -38.54 -61.47 0.7 Allowed 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 125.035 1.334 . . . . 0.0 112.938 -176.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 58.6 tt0 -61.22 -37.82 84.39 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.047 0.539 . . . . 0.0 110.89 -175.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -62.55 -54.18 37.33 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 N-CA-C 105.974 -1.862 . . . . 0.0 105.974 -178.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 59.9 t -54.94 -39.76 50.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 CA-C-O 118.118 -0.944 . . . . 0.0 110.702 176.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 12.6 mmmt -59.96 -51.53 69.27 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 120.226 1.376 . . . . 0.0 110.414 176.292 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 85.1 mt -57.34 -37.6 72.8 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 119.322 -0.371 . . . . 0.0 110.828 -179.474 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 24.0 mmt -70.34 -62.85 1.23 Allowed 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 118.59 0.632 . . . . 0.0 109.992 175.503 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -44.29 -42.47 6.71 Favored 'General case' 0 CA--C 1.52 -0.19 0 C-N-CA 127.472 2.309 . . . . 0.0 111.425 -176.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -38.0 -50.87 1.36 Allowed 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.087 1.355 . . . . 0.0 111.391 174.178 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 71.1 mt -60.54 -35.78 76.85 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 121.924 -0.485 . . . . 0.0 111.667 -175.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -80.81 -54.76 5.32 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.437 0.695 . . . . 0.0 109.824 179.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 14.7 ttm180 . . . . . 0 N--CA 1.455 -0.178 0 C-N-CA 124.473 1.109 . . . . 0.0 110.044 177.741 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 . . . . . 0 N--CA 1.454 -0.262 0 CA-C-O 120.877 0.37 . . . . 0.0 111.587 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 23.4 m -130.86 147.2 33.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 N-CA-C 105.65 -1.981 . . . . 0.0 105.65 166.641 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -88.53 168.29 12.71 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 122.719 0.408 . . . . 0.0 111.194 175.832 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -33.45 -61.55 0.31 Allowed 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.722 1.209 . . . . 0.0 112.854 171.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 38.6 tp60 -61.92 -33.27 73.94 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 119.794 1.179 . . . . 0.0 112.042 -174.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -70.18 -40.01 74.92 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.249 -0.907 . . . . 0.0 110.095 177.076 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -56.92 -48.5 78.11 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 169.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . 0.403 ' CG2' ' CG2' ' B' ' 74' ' ' ILE . 27.3 mm -58.23 -36.64 58.62 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.255 0 O-C-N 121.535 -0.728 . . . . 0.0 110.006 175.701 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 42.5 m -64.35 -38.54 91.4 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.931 0.787 . . . . 0.0 110.489 174.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -55.88 -55.41 32.89 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 172.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 36.3 mt -59.37 -41.98 90.58 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.987 -0.445 . . . . 0.0 112.133 178.262 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.38 -39.96 87.21 Favored Glycine 0 CA--C 1.523 0.593 0 N-CA-C 110.638 -0.985 . . . . 0.0 110.638 -175.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.01 -50.03 67.87 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 117.597 0.699 . . . . 0.0 109.938 173.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -47.92 -56.84 6.64 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 123.988 0.915 . . . . 0.0 110.05 175.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.86 -62.5 1.57 Allowed 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 124.677 1.191 . . . . 0.0 110.327 175.081 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 6.5 ttp -54.92 -37.94 67.02 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.121 0.569 . . . . 0.0 112.039 -173.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 73.6 mt -69.82 -57.84 7.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 CA-C-O 117.975 -1.012 . . . . 0.0 110.877 178.083 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.438 0.2 OUTLIER -77.76 -35.14 52.05 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 120.313 1.415 . . . . 0.0 113.814 -174.208 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.3 m120 -80.55 58.79 3.32 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 106.425 -1.694 . . . . 0.0 106.425 168.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -47.09 -35.22 6.74 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 126.769 2.028 . . . . 0.0 113.505 -167.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -43.12 -36.95 1.85 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.706 1.203 . . . . 0.0 112.953 175.043 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 34.0 mt . . . . . 0 CA--C 1.529 0.165 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 178.011 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.293 0 CA-C-O 120.881 0.372 . . . . 0.0 110.189 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.09 165.55 1.39 Allowed Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 125.53 1.532 . . . . 0.0 111.756 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo -46.14 -50.77 9.5 Favored 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 123.528 2.819 . . . . 0.0 113.052 177.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 6.0 mt -55.9 -52.51 63.85 Favored 'General case' 0 C--N 1.34 0.175 0 O-C-N 122.328 -0.233 . . . . 0.0 111.115 175.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -58.78 -43.59 90.49 Favored 'General case' 0 C--O 1.225 -0.201 0 N-CA-C 110.118 -0.326 . . . . 0.0 110.118 -175.217 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 tp-100 -61.94 -49.72 75.0 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.147 0.979 . . . . 0.0 110.441 177.534 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.87 -44.2 96.74 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.039 0.536 . . . . 0.0 111.222 -178.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 71.3 mt -54.4 -53.31 31.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 169.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -44.97 -48.25 9.45 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 124.947 1.261 . . . . 0.0 111.923 174.436 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 mt -56.61 -57.93 10.24 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 117.679 0.739 . . . . 0.0 110.895 174.199 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.0 mp -56.41 -42.77 78.54 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 119.483 1.038 . . . . 0.0 111.75 -178.35 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 71.6 mt -59.3 -55.25 24.87 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 C-N-CA 123.508 0.723 . . . . 0.0 110.779 174.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.91 -48.99 69.12 Favored Glycine 0 CA--C 1.523 0.549 0 N-CA-C 110.198 -1.161 . . . . 0.0 110.198 -177.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 9.5 mm -51.25 -49.81 28.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 C-N-CA 124.34 1.056 . . . . 0.0 110.103 173.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -56.18 -61.64 2.26 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.082 0.468 . . . . 0.0 109.772 177.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 13.5 m-70 -53.0 -37.09 61.16 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.936 0.894 . . . . 0.0 112.812 -176.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 62.3 tttm -47.12 -35.67 7.45 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.904 0.881 . . . . 0.0 111.368 175.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -102.95 -66.99 0.9 Allowed 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 173.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.227 -0.111 0 C-N-CA 123.899 0.88 . . . . 0.0 112.152 -170.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 13.9 t-160 . . . . . 0 CA--C 1.536 0.44 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 45.4 p -140.07 148.75 42.22 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.329 1.052 . . . . 0.0 113.804 -168.1 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -151.61 173.44 14.65 Favored 'General case' 0 CA--C 1.527 0.067 0 C-N-CA 123.263 0.625 . . . . 0.0 110.03 171.471 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 22.2 p -117.67 174.24 6.28 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 124.495 1.118 . . . . 0.0 113.318 -169.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 6.6 pttp -34.79 -59.77 0.47 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 126.867 2.067 . . . . 0.0 112.986 175.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 35.3 tptt -44.87 -49.51 10.87 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 124.558 1.143 . . . . 0.0 111.797 176.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -70.34 -36.0 73.94 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 122.902 0.481 . . . . 0.0 110.632 -176.329 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 34.6 mt -64.33 -46.66 82.54 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.647 0.658 . . . . 0.0 110.789 174.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -55.6 -51.87 65.7 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 174.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 68.3 mt-10 -56.51 -47.43 79.36 Favored 'General case' 0 C--O 1.218 -0.56 0 CA-C-O 118.969 -0.539 . . . . 0.0 110.856 176.073 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 8.5 mt -51.0 -53.22 35.23 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 119.574 1.079 . . . . 0.0 110.464 179.339 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 1.4 mp -56.09 -58.61 4.51 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 174.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -55.23 -43.93 75.01 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -172.254 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 6.9 mmpt? -83.11 -54.59 4.93 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 125.667 1.587 . . . . 0.0 109.916 -172.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 44.7 mm-40 -94.42 -17.26 22.68 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 -167.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 67.4 mt . . . . . 0 N--CA 1.457 -0.082 0 C-N-CA 123.907 0.883 . . . . 0.0 108.997 170.793 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 . . . . . 0 C--O 1.226 -0.142 0 N-CA-C 113.523 0.935 . . . . 0.0 113.523 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.49 -60.31 0.15 Allowed 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 126.076 1.75 . . . . 0.0 113.344 -179.195 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -69.75 -36.84 76.15 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 122.248 0.219 . . . . 0.0 111.194 -172.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.3 mp -62.86 -55.3 24.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 178.455 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 78.3 t -55.84 -46.01 79.9 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 C-N-CA 124.709 1.204 . . . . 0.0 110.015 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -53.6 -53.47 51.28 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 118.216 0.462 . . . . 0.0 110.791 173.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 68.7 mt -56.53 -43.86 80.26 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 119.116 -0.468 . . . . 0.0 111.452 178.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 25.7 mmt -62.42 -59.27 5.22 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 118.816 0.734 . . . . 0.0 109.393 178.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -54.22 -40.76 67.97 Favored 'General case' 0 N--CA 1.457 -0.112 0 C-N-CA 125.303 1.441 . . . . 0.0 111.007 -175.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -38.93 -50.97 1.78 Allowed 'General case' 0 C--O 1.232 0.158 0 C-N-CA 125.747 1.619 . . . . 0.0 112.555 -173.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 3.0 pp -58.86 -39.26 80.81 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 -176.127 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -77.0 -45.7 26.42 Favored 'General case' 0 N--CA 1.456 -0.157 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 177.51 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 23.4 ttm-85 -48.93 -44.53 40.55 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.532 0.733 . . . . 0.0 109.979 179.086 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 . . . . . 0 CA--C 1.532 0.284 0 C-N-CA 123.1 0.56 . . . . 0.0 111.86 179.561 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 . . . . . 0 N--CA 1.455 -0.209 0 CA-C-O 121.213 0.53 . . . . 0.0 111.818 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 36.0 m -124.9 152.39 31.19 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 C-N-CA 126.607 1.963 . . . . 0.0 106.081 167.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 10.6 p30 -91.5 169.23 10.94 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 123.156 0.582 . . . . 0.0 110.54 175.389 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -35.58 -60.67 0.5 Allowed 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 125.125 1.37 . . . . 0.0 113.243 177.019 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 37.9 tp60 -63.88 -31.46 72.65 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 119.752 1.16 . . . . 0.0 111.294 -173.012 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.67 -36.39 62.8 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 121.56 -0.712 . . . . 0.0 110.186 177.848 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -56.86 -49.59 75.04 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 168.363 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . 0.403 ' CG2' ' CG2' ' A' ' 74' ' ' ILE . 24.2 mm -57.38 -39.1 66.24 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 O-C-N 121.963 -0.461 . . . . 0.0 110.012 175.821 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 55.3 m -62.45 -40.82 97.85 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 118.946 0.793 . . . . 0.0 110.608 175.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -53.37 -55.98 20.53 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 173.492 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 51.0 mt -61.16 -40.86 95.45 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 179.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -70.26 -43.87 61.7 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 110.788 -0.925 . . . . 0.0 110.788 -174.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.5 -46.89 81.01 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 117.705 0.752 . . . . 0.0 109.894 174.466 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 12.2 tp -49.7 -56.05 11.58 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.419 0.628 . . . . 0.0 109.559 174.274 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.08 -53.63 40.01 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.882 1.273 . . . . 0.0 110.802 177.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 52.9 ttm -54.11 -49.58 68.8 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 124.31 1.044 . . . . 0.0 110.552 -179.65 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 76.4 mt -62.54 -59.19 4.75 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.33 0 CA-C-O 118.701 -0.666 . . . . 0.0 109.586 -176.475 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.388 0.1 OUTLIER -71.25 -35.11 71.3 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 118.467 -1.293 . . . . 0.0 112.938 -174.365 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 37.3 m-80 -81.07 72.08 8.08 Favored 'General case' 0 N--CA 1.462 0.16 0 O-C-N 120.793 -1.192 . . . . 0.0 108.157 170.507 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -43.81 -34.45 1.58 Allowed 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 124.918 1.287 . . . . 0.0 112.725 -179.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -41.1 -42.82 2.08 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.876 1.27 . . . . 0.0 113.189 173.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 96.1 mt . . . . . 0 CA--C 1.532 0.286 0 C-N-CA 123.409 0.684 . . . . 0.0 112.718 -177.432 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.246 0 CA-C-O 121.192 0.52 . . . . 0.0 111.085 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.34 167.79 3.7 Favored Pre-proline 0 CA--C 1.534 0.347 0 C-N-CA 124.795 1.238 . . . . 0.0 111.339 172.878 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_endo -49.63 -45.05 33.08 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 122.926 2.417 . . . . 0.0 111.428 171.28 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.1 mt -53.74 -57.35 11.15 Favored 'General case' 0 C--O 1.224 -0.283 0 CA-C-N 118.02 0.373 . . . . 0.0 111.317 171.606 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -56.84 -42.23 79.29 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.176 0.444 . . . . 0.0 110.831 -174.999 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 -59.74 -50.71 72.76 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.54 0.736 . . . . 0.0 110.842 175.509 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.01 -45.96 83.37 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.577 0.751 . . . . 0.0 111.632 -176.462 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 87.1 mt -53.48 -51.02 45.67 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 169.887 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.04 -49.03 18.91 Favored Glycine 0 CA--C 1.528 0.88 0 C-N-CA 124.923 1.249 . . . . 0.0 112.005 173.55 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 mt -56.82 -55.16 37.89 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 117.947 0.873 . . . . 0.0 110.864 174.893 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.0 mp -57.49 -43.6 84.27 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 119.136 0.88 . . . . 0.0 111.38 -179.024 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 95.4 mt -58.32 -53.11 50.65 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.193 0 C-N-CA 123.497 0.719 . . . . 0.0 110.362 174.207 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.42 -49.66 67.53 Favored Glycine 0 CA--C 1.524 0.596 0 N-CA-C 110.322 -1.111 . . . . 0.0 110.322 -177.953 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 9.6 mm -53.32 -48.52 55.91 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 C-N-CA 123.572 0.749 . . . . 0.0 109.885 174.91 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 53.1 t80 -56.09 -61.13 2.59 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.258 0.481 . . . . 0.0 110.056 176.921 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -51.06 -39.69 56.56 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 125.74 1.616 . . . . 0.0 111.503 -176.27 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -50.93 -36.17 37.18 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.715 0.806 . . . . 0.0 111.506 178.913 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -107.05 -38.21 6.09 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.078 0.551 . . . . 0.0 111.654 -177.929 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 59.6 p . . . . . 0 C--O 1.232 0.134 0 CA-C-N 118.801 0.728 . . . . 0.0 111.772 -178.749 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.3 p . . . . . 0 CA--C 1.529 0.167 0 N-CA-C 111.841 0.311 . . . . 0.0 111.841 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -150.21 161.58 42.14 Favored 'General case' 0 CA--C 1.528 0.109 0 C-N-CA 123.034 0.534 . . . . 0.0 111.177 168.649 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 83.7 p -87.07 164.74 16.27 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 115.638 1.718 . . . . 0.0 115.638 -168.063 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 20.7 ttmm -42.6 -54.17 4.09 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 126.878 2.071 . . . . 0.0 109.442 166.685 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -58.01 -54.27 48.79 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.075 0.95 . . . . 0.0 109.782 179.247 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.12 -34.19 73.17 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 118.91 -0.567 . . . . 0.0 111.746 -177.49 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 44.0 mt -65.61 -52.71 49.95 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 119.276 0.943 . . . . 0.0 111.345 173.999 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -60.45 -35.96 77.08 Favored 'General case' 0 CA--C 1.532 0.261 0 O-C-N 122.3 -0.25 . . . . 0.0 110.439 -179.43 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 88.4 mt-10 -60.13 -68.71 0.27 Allowed 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 168.383 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.5 mt -32.57 -61.65 0.26 Allowed 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 125.94 1.696 . . . . 0.0 112.388 -177.965 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.3 tt -57.14 -52.19 59.41 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 110.337 -0.246 . . . . 0.0 110.337 -174.844 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.0 tt0 -64.33 -44.99 89.81 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 121.905 -0.497 . . . . 0.0 111.643 -177.874 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.0 mmpt? -64.6 -51.35 63.16 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 124.894 1.278 . . . . 0.0 110.219 -175.619 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 65.1 mm-40 -90.24 -47.52 7.73 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 123.483 0.713 . . . . 0.0 111.582 -168.911 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 18.1 mt . . . . . 0 C--N 1.339 0.122 0 CA-C-N 118.976 0.807 . . . . 0.0 110.386 -177.828 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 28.0 t70 . . . . . 0 N--CA 1.463 0.208 0 N-CA-C 116.066 1.876 . . . . 0.0 116.066 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -33.03 -59.06 0.36 Allowed 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.591 1.556 . . . . 0.0 113.396 -179.454 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -64.94 -36.88 85.8 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 121.255 0.55 . . . . 0.0 110.775 -173.815 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -65.56 -53.94 33.67 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.572 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 -178.068 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 75.4 t -57.91 -43.82 85.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 CA-C-O 118.633 -0.698 . . . . 0.0 110.451 178.86 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.72 -53.7 51.54 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 119.385 0.993 . . . . 0.0 110.459 174.301 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.6 mt -52.83 -44.26 66.58 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 119.104 -0.474 . . . . 0.0 111.404 178.651 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 25.9 mmt -66.84 -66.15 0.59 Allowed 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.529 0.604 . . . . 0.0 109.456 177.632 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -40.46 -42.68 1.67 Allowed 'General case' 0 CA--C 1.519 -0.243 0 C-N-CA 127.803 2.441 . . . . 0.0 111.648 -176.738 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -39.22 -47.7 1.68 Allowed 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 123.862 0.865 . . . . 0.0 112.72 178.042 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -64.35 -37.22 86.75 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.044 0.384 . . . . 0.0 111.385 -176.162 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -78.87 -36.88 41.52 Favored 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 123.841 0.856 . . . . 0.0 110.104 -178.284 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.2 ttm180 . . . . . 0 N--CA 1.449 -0.494 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 174.448 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 . . . . . 0 N--CA 1.456 -0.15 0 N-CA-C 111.803 0.297 . . . . 0.0 111.803 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 16.3 m -128.04 157.17 40.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.279 0 C-N-CA 125.325 1.45 . . . . 0.0 107.787 168.62 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -87.18 171.28 10.79 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.048 0.939 . . . . 0.0 111.495 173.522 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 68.8 t80 -44.45 -62.43 1.18 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.945 0.898 . . . . 0.0 113.141 176.172 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 37.0 tp60 -61.61 -34.48 75.73 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 119.722 1.146 . . . . 0.0 110.89 -174.795 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 83.5 mt-10 -64.45 -41.06 96.76 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.445 -0.784 . . . . 0.0 110.925 175.029 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -57.47 -47.97 80.44 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 121.606 -0.684 . . . . 0.0 109.899 169.824 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 31.0 mm -60.35 -29.56 44.48 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 O-C-N 121.503 -0.748 . . . . 0.0 110.767 175.281 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 29.2 m -69.93 -40.74 75.34 Favored 'General case' 0 C--O 1.225 -0.196 0 O-C-N 121.215 -0.928 . . . . 0.0 110.197 173.413 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -56.67 -53.67 54.95 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.571 -0.706 . . . . 0.0 109.576 173.413 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 61.2 mt -63.24 -41.12 99.04 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 121.947 -0.471 . . . . 0.0 111.988 178.437 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.79 -41.26 95.77 Favored Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.737 -0.945 . . . . 0.0 110.737 -179.076 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.34 -46.99 87.93 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.269 0.627 . . . . 0.0 110.127 173.453 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 9.8 tp -51.96 -58.3 6.92 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.714 0.768 . . . . 0.0 109.774 175.402 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -47.83 -53.39 15.72 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 114.486 -1.234 . . . . 0.0 110.089 178.077 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 46.0 ttm -57.59 -51.92 67.51 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 123.684 0.794 . . . . 0.0 111.343 -179.437 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 85.6 mt -61.7 -45.13 99.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.613 -173.712 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.457 0.1 OUTLIER -83.08 -33.99 26.27 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 179.982 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 -84.66 85.57 7.42 Favored 'General case' 0 N--CA 1.463 0.222 0 O-C-N 120.845 -1.159 . . . . 0.0 108.93 173.958 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -36.89 -42.06 0.37 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.654 1.181 . . . . 0.0 113.356 171.741 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -55.33 -17.07 4.12 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 125.298 1.439 . . . . 0.0 114.304 -179.516 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 69.8 mt . . . . . 0 CA--C 1.532 0.263 0 C-N-CA 124.608 1.163 . . . . 0.0 112.616 -179.114 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.299 0 N-CA-C 110.135 -0.32 . . . . 0.0 110.135 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -49.54 155.32 1.38 Allowed Pre-proline 0 CA--C 1.535 0.386 0 C-N-CA 125.354 1.462 . . . . 0.0 109.959 172.189 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_exo -43.76 -52.72 5.09 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 123.38 2.72 . . . . 0.0 113.165 -177.141 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.2 mt -55.44 -55.62 29.57 Favored 'General case' 0 C--O 1.226 -0.153 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 173.514 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -58.18 -38.17 76.15 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-N 118.301 0.5 . . . . 0.0 110.332 -175.048 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -68.55 -49.19 61.39 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 125.088 1.355 . . . . 0.0 110.155 -179.313 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.35 -47.39 86.25 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.553 0.741 . . . . 0.0 110.648 177.991 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 70.0 mt -52.48 -53.86 17.9 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 169.956 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.84 -44.24 17.63 Favored Glycine 0 CA--C 1.526 0.736 0 C-N-CA 125.752 1.644 . . . . 0.0 112.322 175.977 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.68 -53.01 62.96 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.809 0.844 . . . . 0.0 110.686 174.683 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 11.0 mp -58.25 -41.43 84.2 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 119.01 0.823 . . . . 0.0 111.395 178.008 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 84.6 mt -60.29 -51.7 69.91 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 123.651 0.78 . . . . 0.0 110.735 174.563 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.48 -49.21 70.74 Favored Glycine 0 CA--C 1.521 0.445 0 N-CA-C 109.685 -1.366 . . . . 0.0 109.685 -179.083 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.2 mm -54.42 -46.41 70.36 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 C-N-CA 123.139 0.576 . . . . 0.0 110.409 174.594 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 58.5 t80 -55.27 -62.65 1.53 Allowed 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 118.974 0.806 . . . . 0.0 109.949 175.205 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -53.15 -38.42 62.72 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.329 1.052 . . . . 0.0 111.66 -175.092 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -47.86 -38.39 16.06 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.059 0.944 . . . . 0.0 111.391 176.986 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -99.35 -59.09 1.79 Allowed 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 177.343 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 4.7 m . . . . . 0 C--O 1.227 -0.1 0 C-N-CA 124.215 1.006 . . . . 0.0 112.507 -175.019 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 3.8 m80 . . . . . 0 CA--C 1.535 0.396 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 2.4 p -122.56 167.32 13.52 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 127.232 2.213 . . . . 0.0 110.381 -179.888 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -152.53 163.52 39.42 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.771 0.829 . . . . 0.0 109.523 167.568 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 14.5 m -84.98 147.17 26.84 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.265 1.026 . . . . 0.0 110.241 176.987 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -53.7 -31.43 47.97 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 -175.176 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.4 tmmt? -50.34 -43.52 54.1 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.884 -0.51 . . . . 0.0 110.184 172.024 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -65.89 -29.68 70.15 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-O 117.847 -1.073 . . . . 0.0 111.794 177.107 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 89.5 mt -65.5 -48.88 71.05 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 120.522 1.51 . . . . 0.0 109.299 174.409 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 59.4 mtmt -60.5 -44.78 95.62 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.228 179.789 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 72.7 mt-10 -55.07 -66.52 0.39 Allowed 'General case' 0 C--O 1.219 -0.536 0 CA-C-O 118.552 -0.737 . . . . 0.0 109.585 170.252 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 9.4 mt -35.93 -60.56 0.53 Allowed 'General case' 0 C--O 1.23 0.065 0 C-N-CA 125.294 1.437 . . . . 0.0 111.475 -179.82 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 1.5 tp -60.36 -51.68 70.16 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.103 -174.605 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -66.07 -44.75 83.6 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.728 0.694 . . . . 0.0 111.986 -175.463 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 6.9 mmpt? -61.87 -58.89 6.21 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 125.4 1.48 . . . . 0.0 109.26 -179.138 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -79.46 -54.76 5.6 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.782 -0.644 . . . . 0.0 109.3 -170.069 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 42.1 mt . . . . . 0 C--N 1.334 -0.084 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 172.291 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 1.5 p30 . . . . . 0 N--CA 1.466 0.354 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.25 -66.65 0.09 Allowed 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 126.983 2.113 . . . . 0.0 114.221 -174.732 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -65.34 -39.16 92.03 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-O 121.051 0.453 . . . . 0.0 110.222 -171.024 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.6 mp -64.35 -54.23 33.42 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 -176.946 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 75.6 t -58.09 -44.05 86.55 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.459 0 CA-C-O 118.406 -0.807 . . . . 0.0 110.196 178.794 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -54.92 -52.87 61.6 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 119.528 1.058 . . . . 0.0 110.509 174.396 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 37.0 mt -54.21 -46.18 72.39 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 119.17 -0.443 . . . . 0.0 111.243 179.496 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 26.5 mmt -66.9 -59.24 3.68 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.534 0.683 . . . . 0.0 109.868 179.309 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -48.71 -39.73 25.77 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 126.58 1.952 . . . . 0.0 111.337 -177.079 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -37.6 -50.22 1.14 Allowed 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 126.024 1.73 . . . . 0.0 112.507 -174.195 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 3.1 pp -62.97 -35.57 80.61 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 -175.366 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -85.99 -33.2 21.15 Favored 'General case' 0 C--O 1.224 -0.286 0 C-N-CA 123.184 0.593 . . . . 0.0 110.457 178.512 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 6.6 ttp180 -58.86 -56.62 19.84 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 122.111 0.957 . . . . 0.0 108.603 175.186 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 . . . . . 0 N--CA 1.45 -0.452 0 C-N-CA 124.238 1.015 . . . . 0.0 109.74 -172.73 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 . . . . . 0 N--CA 1.453 -0.302 0 CA-C-O 120.358 0.123 . . . . 0.0 110.923 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 6.0 m -136.88 160.0 36.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 C-N-CA 124.122 0.969 . . . . 0.0 109.471 169.236 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 17.4 p30 -85.94 169.2 13.48 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 125.759 1.623 . . . . 0.0 110.886 174.327 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -39.92 -58.75 1.33 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.982 1.313 . . . . 0.0 113.664 173.932 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 38.4 tp60 -61.76 -40.97 97.0 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 120.786 -1.196 . . . . 0.0 110.981 -174.239 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -68.02 -33.82 75.32 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.78 -0.575 . . . . 0.0 110.862 177.94 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -57.72 -55.09 39.33 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 168.669 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 22.1 mm -52.79 -42.62 42.89 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.212 0 C-N-CA 122.821 0.448 . . . . 0.0 109.95 179.7 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 49.5 m -55.4 -36.29 66.28 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 122.779 0.432 . . . . 0.0 111.376 178.425 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 18.3 t80 -58.46 -53.1 62.09 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 174.969 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 41.8 mt -60.51 -43.07 97.45 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.056 0.542 . . . . 0.0 111.17 178.715 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.23 -46.77 86.05 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 -176.654 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.39 -46.92 88.15 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 117.696 0.748 . . . . 0.0 110.543 175.84 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -51.83 -56.15 15.72 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.766 0.793 . . . . 0.0 109.983 174.426 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.43 -48.98 65.44 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 124.113 0.965 . . . . 0.0 110.474 178.457 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 50.3 ttm -58.3 -49.5 76.93 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.912 0.885 . . . . 0.0 110.971 179.855 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 84.1 mt -64.6 -43.39 96.72 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 CA-C-O 118.186 -0.912 . . . . 0.0 111.233 -175.596 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.445 1.3 p90 -79.43 -40.34 30.18 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.784 1.174 . . . . 0.0 113.607 178.694 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 37.4 m-80 -79.14 70.73 5.56 Favored 'General case' 0 N--CA 1.462 0.136 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 170.567 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -40.89 -41.98 1.73 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.521 1.528 . . . . 0.0 112.6 -174.841 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.29 -54.33 0.4 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.766 1.626 . . . . 0.0 113.044 169.954 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 85.4 mt . . . . . 0 C--O 1.225 -0.235 0 C-N-CA 124.146 0.978 . . . . 0.0 113.146 -173.555 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.225 0 CA-C-O 120.862 0.363 . . . . 0.0 110.238 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 4.2 m -53.35 160.54 1.74 Allowed Pre-proline 0 CA--C 1.536 0.442 0 C-N-CA 124.278 1.031 . . . . 0.0 111.113 175.09 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_exo -43.15 -49.5 7.13 Favored 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 123.528 2.819 . . . . 0.0 113.172 176.28 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 7.3 mt -57.25 -48.5 78.68 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 119.305 -0.379 . . . . 0.0 111.719 174.577 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -59.41 -47.18 86.46 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 118.548 0.613 . . . . 0.0 109.666 -177.081 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 16.0 tt0 -56.08 -52.69 63.38 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.355 0.662 . . . . 0.0 110.375 176.209 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.52 -45.11 84.75 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.383 0.673 . . . . 0.0 112.023 -174.606 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 76.0 mt -55.69 -50.18 69.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 171.534 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.21 -50.03 17.68 Favored Glycine 0 CA--C 1.528 0.863 0 C-N-CA 124.422 1.011 . . . . 0.0 111.488 173.609 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.1 mt -55.83 -56.76 16.77 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 117.586 0.693 . . . . 0.0 111.282 174.848 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -58.32 -44.14 88.51 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 119.257 0.935 . . . . 0.0 111.639 -177.659 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 96.3 mt -56.49 -54.91 22.77 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.2 0 C-N-CA 123.413 0.685 . . . . 0.0 110.198 173.181 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.64 -50.15 58.62 Favored Glycine 0 CA--C 1.523 0.567 0 N-CA-C 110.364 -1.094 . . . . 0.0 110.364 -177.351 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 9.5 mm -54.27 -47.62 68.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 C-N-CA 123.229 0.611 . . . . 0.0 110.107 175.915 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 50.6 t80 -56.1 -59.35 5.05 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.401 0.546 . . . . 0.0 109.998 176.506 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -56.62 -35.47 68.34 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.734 1.214 . . . . 0.0 111.514 -173.732 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -48.88 -36.33 16.81 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.943 0.897 . . . . 0.0 111.779 177.143 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 54.6 m-85 -106.81 -55.73 2.29 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.34 0.656 . . . . 0.0 109.393 178.461 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.531 0.217 0 C-N-CA 124.103 0.961 . . . . 0.0 111.645 -176.38 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.3 p . . . . . 0 N--CA 1.454 -0.242 0 N-CA-C 111.27 0.1 . . . . 0.0 111.27 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -144.46 163.56 33.45 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.573 0.349 . . . . 0.0 111.526 169.709 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 9.7 m -89.36 159.89 17.12 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.095 0.958 . . . . 0.0 113.438 -170.667 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 51.6 pttt -45.99 -42.84 13.64 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 125.272 1.429 . . . . 0.0 112.184 171.793 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 23.2 ttmm -51.97 -50.47 61.2 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 123.483 0.713 . . . . 0.0 110.302 172.815 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 -65.83 -39.99 91.35 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 118.776 -0.631 . . . . 0.0 110.324 -176.897 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 76.0 mt -58.82 -54.97 41.13 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.77 0.713 . . . . 0.0 111.161 173.462 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 61.8 mttm -56.56 -44.27 80.8 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.236 0.614 . . . . 0.0 110.187 -178.422 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -56.81 -67.93 0.27 Allowed 'General case' 0 C--O 1.219 -0.507 0 CA-C-O 118.423 -0.799 . . . . 0.0 109.473 170.555 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.7 mt -34.07 -62.98 0.3 Allowed 'General case' 0 N--CA 1.463 0.209 0 C-N-CA 125.594 1.558 . . . . 0.0 112.132 -178.542 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 18.1 tt -61.26 -48.0 90.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 C-N-CA 120.899 -0.321 . . . . 0.0 110.265 -174.356 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -62.91 -45.55 91.98 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.783 -0.573 . . . . 0.0 111.712 -178.065 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.2 mmpt? -65.07 -58.68 5.44 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 125.397 1.479 . . . . 0.0 109.059 -176.727 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -77.78 -62.36 1.69 Allowed 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.311 -173.226 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 32.8 mt . . . . . 0 N--CA 1.45 -0.427 0 CA-C-O 121.394 0.616 . . . . 0.0 109.557 -174.956 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 38.2 t70 . . . . . 0 N--CA 1.463 0.197 0 N-CA-C 115.207 1.558 . . . . 0.0 115.207 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -31.99 -58.15 0.3 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 125.49 1.516 . . . . 0.0 113.35 176.866 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -65.92 -38.42 88.64 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 121.268 0.556 . . . . 0.0 111.197 -175.289 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -66.06 -50.13 71.55 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 N-CA-C 106.864 -1.532 . . . . 0.0 106.864 -176.157 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 71.6 t -55.49 -54.31 26.87 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 CA-C-O 118.475 -0.774 . . . . 0.0 109.364 174.682 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -47.98 -54.45 12.82 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.629 0.65 . . . . 0.0 110.847 179.332 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 12.8 mt -51.94 -43.35 63.42 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 122.879 0.472 . . . . 0.0 112.197 -177.249 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -78.69 -59.38 2.8 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 122.926 0.49 . . . . 0.0 110.335 -179.661 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -39.71 -37.2 0.49 Allowed 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 126.785 2.034 . . . . 0.0 111.872 176.575 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -36.75 -57.3 0.8 Allowed 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 125.239 1.416 . . . . 0.0 111.408 172.871 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -65.42 -30.75 71.59 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 121.856 -0.527 . . . . 0.0 111.658 -174.346 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -82.1 -36.67 27.33 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.43 0.692 . . . . 0.0 110.523 -175.036 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 13.1 ptt180 . . . . . 0 CA--C 1.532 0.269 0 CA-C-N 118.813 0.733 . . . . 0.0 109.422 173.714 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 . . . . . 0 CA--C 1.528 0.13 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.7 m -134.37 159.43 42.01 Favored 'Isoleucine or valine' 0 C--O 1.232 0.159 0 C-N-CA 126.224 1.81 . . . . 0.0 107.805 169.406 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -91.44 174.26 7.47 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 123.612 0.765 . . . . 0.0 111.59 175.798 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 49.3 t80 -42.31 -63.46 0.75 Allowed 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.376 1.07 . . . . 0.0 112.84 173.839 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -61.64 -35.25 77.38 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 120.329 1.422 . . . . 0.0 111.694 -176.179 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -63.6 -41.4 98.32 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 119.836 1.198 . . . . 0.0 111.315 174.33 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -55.04 -51.63 65.69 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 121.01 -1.056 . . . . 0.0 109.608 169.853 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 23.8 mm -55.97 -36.13 43.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 C-N-CA 122.804 0.442 . . . . 0.0 110.245 176.395 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 56.8 m -67.2 -34.48 77.6 Favored 'General case' 0 C--O 1.225 -0.223 0 O-C-N 121.302 -0.874 . . . . 0.0 110.635 177.06 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -53.91 -54.48 38.2 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 169.813 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 59.6 mt -64.2 -41.36 97.11 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.306 0.642 . . . . 0.0 112.034 -178.254 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -70.16 -44.46 60.27 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.416 -1.073 . . . . 0.0 110.416 -176.689 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.08 -49.58 76.74 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 122.171 -0.605 . . . . 0.0 109.754 174.393 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 11.1 tp -48.45 -59.27 3.61 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.464 0.65 . . . . 0.0 109.988 173.922 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -49.64 -53.02 26.59 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.804 1.242 . . . . 0.0 110.581 179.773 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 14.2 ttp -67.1 -36.61 82.31 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 123.357 0.663 . . . . 0.0 111.92 -175.166 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.93 -59.39 4.35 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 CA-C-N 118.791 0.723 . . . . 0.0 109.52 175.679 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.417 0.3 OUTLIER -70.91 -38.33 72.95 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 118.512 -1.275 . . . . 0.0 112.424 -174.21 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -81.78 67.68 7.85 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 120.545 -1.347 . . . . 0.0 107.639 168.994 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -41.24 -40.13 1.53 Allowed 'General case' 0 N--CA 1.462 0.155 0 C-N-CA 125.767 1.627 . . . . 0.0 112.293 -175.242 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -34.55 -53.28 0.52 Allowed 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 125.352 1.461 . . . . 0.0 113.037 172.401 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 90.9 mt . . . . . 0 C--O 1.225 -0.23 0 N-CA-C 113.156 0.798 . . . . 0.0 113.156 -174.226 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.227 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 11.9 m -53.8 159.7 2.51 Favored Pre-proline 0 CA--C 1.537 0.479 0 C-N-CA 123.741 0.816 . . . . 0.0 111.147 176.512 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_exo -42.11 -48.83 6.19 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 123.868 3.045 . . . . 0.0 113.507 177.645 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 6.3 mt -54.25 -51.11 65.55 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 119.564 -0.255 . . . . 0.0 111.521 174.051 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -62.99 -40.46 97.8 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 118.254 0.479 . . . . 0.0 110.144 -175.674 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.7 tp60 -63.9 -46.35 85.24 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 122.512 -0.118 . . . . 0.0 110.96 176.391 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.31 -46.01 88.71 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.593 0.757 . . . . 0.0 110.819 -179.313 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 63.0 mt -52.84 -53.23 22.27 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.254 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 169.678 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.77 -46.66 18.86 Favored Glycine 0 CA--C 1.528 0.854 0 C-N-CA 125.164 1.364 . . . . 0.0 112.05 175.422 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 mt -58.09 -54.19 49.81 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 117.71 0.755 . . . . 0.0 111.166 174.534 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 9.9 mp -57.91 -42.78 85.49 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 118.791 0.723 . . . . 0.0 111.407 179.323 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 85.9 mt -56.4 -56.13 15.27 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.401 0 C-N-CA 123.629 0.772 . . . . 0.0 109.669 173.316 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.2 -48.8 62.23 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.749 -0.94 . . . . 0.0 110.749 -177.754 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 9.1 mm -56.44 -47.23 81.93 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 175.978 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -55.99 -60.81 2.94 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 118.626 0.648 . . . . 0.0 109.923 176.484 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -43.32 -50.1 6.73 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 128.168 2.587 . . . . 0.0 110.467 -177.992 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -48.38 -36.84 15.41 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.583 1.153 . . . . 0.0 112.355 178.266 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 -119.48 36.12 4.6 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.124 0.97 . . . . 0.0 111.236 179.875 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 19.9 p . . . . . 0 N--CA 1.466 0.372 0 O-C-N 121.309 -0.869 . . . . 0.0 109.793 172.505 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 20.1 t-160 . . . . . 0 CA--C 1.54 0.595 0 N-CA-C 111.358 0.132 . . . . 0.0 111.358 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 73.4 p -128.33 164.81 21.83 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 124.819 1.248 . . . . 0.0 112.393 -173.136 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 3.4 pp -156.49 178.18 10.61 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.88 1.672 . . . . 0.0 107.225 169.78 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 61.8 p -123.46 177.03 5.82 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 119.326 0.966 . . . . 0.0 112.43 -177.369 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 7.0 ptpp? -40.3 -46.88 2.4 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 125.475 1.51 . . . . 0.0 112.945 175.659 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -62.59 -42.64 99.68 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -176.3 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -67.58 -41.44 84.12 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.301 178.182 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 13.7 mt -58.98 -48.89 79.95 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 119.424 1.011 . . . . 0.0 111.107 175.23 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -57.22 -50.52 72.62 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 178.341 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 64.2 mt-10 -50.8 -62.25 1.72 Allowed 'General case' 0 C--O 1.223 -0.334 0 CA-C-O 119.432 -0.318 . . . . 0.0 110.359 173.619 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 12.3 mt -43.1 -64.86 0.56 Allowed 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.86 1.264 . . . . 0.0 110.841 179.573 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 13.8 tt -61.66 -47.73 91.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 C-N-CA 120.452 -0.499 . . . . 0.0 110.382 -171.456 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -67.37 -49.38 64.19 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 118.271 0.487 . . . . 0.0 111.819 -176.009 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.15 -55.38 16.65 Favored 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 -178.054 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -73.03 -51.21 19.05 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 122.354 -0.216 . . . . 0.0 110.43 -172.211 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 96.0 mt . . . . . 0 C--O 1.226 -0.139 0 CA-C-O 121.205 0.526 . . . . 0.0 111.099 -174.043 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 . . . . . 0 N--CA 1.463 0.214 0 N-CA-C 114.66 1.356 . . . . 0.0 114.66 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.68 -60.63 0.15 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.999 1.72 . . . . 0.0 114.264 -179.198 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -65.59 -38.69 90.23 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 121.306 0.574 . . . . 0.0 111.307 -174.058 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 2.4 mp -67.69 -52.97 34.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.548 0 N-CA-C 106.597 -1.631 . . . . 0.0 106.597 -176.443 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 55.4 t -49.18 -48.92 17.41 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 C-N-CA 125.003 1.321 . . . . 0.0 109.645 173.467 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -57.67 -50.02 74.56 Favored 'General case' 0 N--CA 1.457 -0.111 0 CA-C-N 118.577 0.626 . . . . 0.0 111.119 177.708 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 23.9 mt -54.74 -36.6 64.96 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 119.111 -0.471 . . . . 0.0 111.487 177.381 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 28.1 mmt -70.1 -59.52 2.85 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 118.963 0.801 . . . . 0.0 109.838 174.676 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 81.0 m-20 -45.55 -37.39 5.4 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 126.549 1.94 . . . . 0.0 111.27 -178.483 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -38.08 -51.9 1.41 Allowed 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 126.039 1.736 . . . . 0.0 111.029 176.398 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -59.77 -47.42 85.74 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 122.702 0.401 . . . . 0.0 110.35 -177.864 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -63.1 -53.96 45.41 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 122.703 0.401 . . . . 0.0 110.072 -179.418 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 61.4 mtp180 -54.98 -41.86 71.73 Favored 'General case' 0 N--CA 1.456 -0.157 0 O-C-N 121.955 -0.466 . . . . 0.0 110.301 179.897 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 15.4 m-80 . . . . . 0 N--CA 1.455 -0.195 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 179.098 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 . . . . . 0 N--CA 1.453 -0.277 0 CA-C-O 120.94 0.4 . . . . 0.0 110.74 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 10.1 m -130.92 158.63 43.26 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 C-N-CA 126.686 1.995 . . . . 0.0 106.666 168.849 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -99.81 175.2 5.87 Favored 'General case' 0 N--CA 1.462 0.13 0 C-N-CA 124.053 0.941 . . . . 0.0 111.13 177.688 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -40.96 -63.83 0.62 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.239 1.015 . . . . 0.0 112.61 172.38 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 50.9 tp60 -61.52 -36.34 80.28 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 119.59 1.087 . . . . 0.0 111.711 -174.842 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -62.7 -43.01 99.9 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.374 -0.829 . . . . 0.0 110.775 175.62 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -56.29 -51.29 68.71 Favored 'General case' 0 CA--C 1.535 0.403 0 O-C-N 121.838 -0.539 . . . . 0.0 109.884 170.975 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 27.5 mm -55.58 -37.57 46.4 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 O-C-N 121.959 -0.463 . . . . 0.0 110.289 177.554 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 47.8 m -64.76 -37.11 86.51 Favored 'General case' 0 CA--C 1.529 0.139 0 O-C-N 121.682 -0.636 . . . . 0.0 110.603 175.95 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -55.82 -52.98 62.14 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 173.663 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 54.6 mt -62.29 -44.69 95.94 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.55 179.377 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -60.99 -47.91 88.9 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 110.681 -0.968 . . . . 0.0 110.681 -178.901 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.16 -41.22 94.9 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 122.147 -0.619 . . . . 0.0 110.407 177.433 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 23.0 tp -54.04 -56.82 14.36 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 118.636 0.653 . . . . 0.0 109.688 174.611 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -48.58 -50.92 30.36 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 124.524 1.129 . . . . 0.0 109.989 175.891 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 44.7 ttm -58.15 -49.11 78.12 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.209 0.604 . . . . 0.0 111.669 -179.078 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 81.1 mt -65.27 -51.12 68.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.67 -176.033 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.45 0.1 OUTLIER -76.34 -38.64 55.63 Favored 'General case' 0 C--N 1.345 0.392 0 CA-C-N 119.678 1.127 . . . . 0.0 112.958 -177.153 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 23.2 m-80 -82.93 68.57 9.47 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 169.33 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 87.8 mt-10 -41.56 -38.57 1.37 Allowed 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 125.749 1.619 . . . . 0.0 112.688 -173.309 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -35.44 -53.97 0.66 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.046 1.338 . . . . 0.0 112.768 171.583 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 92.3 mt . . . . . 0 CA--C 1.53 0.178 0 C-N-CA 124.037 0.935 . . . . 0.0 113.347 -174.46 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.1 mtm . . . . . 0 N--CA 1.475 0.787 0 CA-C-O 120.671 0.272 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.26 68.55 3.4 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 176.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -56.57 165.04 1.76 Allowed Pre-proline 0 CA--C 1.538 0.499 0 C-N-CA 124.651 1.18 . . . . 0.0 111.461 -179.556 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -44.03 -48.49 9.32 Favored 'Trans proline' 0 N--CA 1.458 -0.563 0 C-N-CA 123.805 3.004 . . . . 0.0 113.535 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.1 mt -53.39 -56.7 14.59 Favored 'General case' 0 C--O 1.226 -0.173 0 CA-C-N 117.66 0.209 . . . . 0.0 111.47 173.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -59.82 -41.78 92.05 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -174.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 tp-100 -60.47 -50.13 74.81 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.619 0.767 . . . . 0.0 110.437 176.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.31 -44.77 94.02 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.331 0.652 . . . . 0.0 111.213 -178.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 74.1 mt -52.41 -53.01 21.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 169.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.55 -47.97 17.24 Favored Glycine 0 CA--C 1.528 0.85 0 C-N-CA 125.254 1.406 . . . . 0.0 112.029 174.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 mt -56.77 -55.9 28.39 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 117.904 0.852 . . . . 0.0 111.051 174.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -56.92 -42.61 80.3 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 119.152 0.887 . . . . 0.0 111.318 -179.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 87.3 mt -57.11 -54.42 30.46 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 C-N-CA 123.305 0.642 . . . . 0.0 110.843 172.774 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.91 -49.87 64.32 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.211 -1.155 . . . . 0.0 110.211 -177.387 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 12.5 mm -52.48 -50.14 40.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 C-N-CA 124.027 0.931 . . . . 0.0 110.067 175.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -53.79 -62.29 1.75 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 121.346 0.593 . . . . 0.0 109.822 176.088 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -55.39 -35.12 64.98 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.001 0.92 . . . . 0.0 111.873 -173.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -48.7 -36.3 15.87 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.886 0.874 . . . . 0.0 111.659 176.416 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 56.3 m-85 -103.61 -56.43 2.21 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 123.125 0.57 . . . . 0.0 109.756 176.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.0 m -50.54 -37.24 38.25 Favored 'General case' 0 C--O 1.227 -0.08 0 C-N-CA 123.533 0.733 . . . . 0.0 111.93 -176.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -40.48 -43.28 2.84 Favored Glycine 0 CA--C 1.526 0.73 0 C-N-CA 124.64 1.114 . . . . 0.0 112.933 174.391 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp -72.78 -21.81 60.93 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 122.687 0.395 . . . . 0.0 111.989 -174.108 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -80.58 2.06 27.15 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.67 0.788 . . . . 0.0 112.685 -170.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 75.78 -67.68 2.29 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.26 -1.136 . . . . 0.0 110.26 179.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -78.6 65.11 3.79 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 170.34 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 8.9 ptpt -66.31 5.02 0.61 Allowed 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 115.146 1.536 . . . . 0.0 115.146 -169.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 6.3 m80 -79.26 -14.99 58.68 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.68 1.592 . . . . 0.0 109.668 169.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 69.5 p -128.17 169.4 14.17 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 126.299 1.839 . . . . 0.0 110.815 179.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.83 -171.73 3.21 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 125.952 1.701 . . . . 0.0 107.556 168.26 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 92.2 p -145.49 177.0 9.17 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 119.589 1.086 . . . . 0.0 112.672 -176.156 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -18.61 -64.64 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 130.919 3.687 . . . . 0.0 113.257 172.402 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.09 -53.23 59.57 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 123.918 0.887 . . . . 0.0 111.201 -178.016 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -61.87 -38.08 86.95 Favored 'General case' 0 C--O 1.222 -0.357 0 C-N-CA 123.077 0.551 . . . . 0.0 110.424 179.481 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 43.7 mt -64.81 -48.78 73.17 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 118.676 0.671 . . . . 0.0 110.979 178.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -57.69 -47.9 81.04 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 110.218 -0.29 . . . . 0.0 110.218 175.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -52.14 -59.14 4.72 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-O 119.396 -0.335 . . . . 0.0 110.695 172.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.3 mt -45.01 -61.53 1.59 Allowed 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 124.771 1.228 . . . . 0.0 110.551 -178.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 12.5 tt -62.08 -51.55 71.07 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 119.983 -0.687 . . . . 0.0 109.717 -174.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -61.88 -44.8 96.07 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.8 -0.562 . . . . 0.0 112.263 -174.493 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -75.12 -58.28 3.38 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 -177.545 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 18.0 mp0 -77.66 -18.82 56.32 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 117.634 -1.174 . . . . 0.0 113.305 -168.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 67.0 mt -102.76 92.44 4.61 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-N 120.133 1.333 . . . . 0.0 107.639 167.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 68.6 p -77.38 60.24 1.99 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.358 1.063 . . . . 0.0 109.184 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 33.5 mt -86.58 -55.05 7.06 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 C-N-CA 124.751 1.221 . . . . 0.0 109.207 -173.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.8 -67.47 1.34 Allowed Glycine 0 CA--C 1.531 1.037 0 N-CA-C 110.707 -0.957 . . . . 0.0 110.707 -174.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 60.5 p -72.01 78.82 0.92 Allowed 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.739 0.816 . . . . 0.0 109.454 175.129 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -33.15 92.69 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 127.615 2.366 . . . . 0.0 112.105 175.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 95.2 mt -61.79 117.98 6.57 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.814 0.845 . . . . 0.0 113.032 -169.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 61.94 -78.0 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 126.102 1.761 . . . . 0.0 113.607 167.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -168.11 -47.3 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 124.226 1.011 . . . . 0.0 109.826 -169.448 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -34.89 -63.21 0.33 Allowed 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 125.144 1.378 . . . . 0.0 112.796 -178.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 67.4 tt0 -62.9 -37.01 85.22 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.327 0.651 . . . . 0.0 111.456 -174.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -62.37 -53.99 40.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 N-CA-C 105.868 -1.901 . . . . 0.0 105.868 -179.193 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 75.1 t -57.15 -41.19 77.36 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.606 0 CA-C-O 118.035 -0.983 . . . . 0.0 110.498 177.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.6 mmmt -58.18 -51.7 68.66 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 120.167 1.349 . . . . 0.0 110.192 176.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 49.5 mt -55.73 -43.77 76.9 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 119.162 -0.447 . . . . 0.0 110.925 179.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 22.1 mmt -67.15 -60.75 2.35 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 118.807 0.73 . . . . 0.0 109.624 178.466 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -42.73 -45.56 4.8 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 126.746 2.018 . . . . 0.0 111.213 -178.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -39.41 -47.79 1.84 Allowed 'General case' 0 C--O 1.234 0.252 0 C-N-CA 124.578 1.151 . . . . 0.0 112.36 178.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -57.99 -48.22 80.64 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-O 119.456 -0.307 . . . . 0.0 110.345 -178.356 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -71.02 -49.05 49.26 Favored 'General case' 0 C--O 1.227 -0.126 0 CA-C-N 118.14 0.427 . . . . 0.0 110.335 -178.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 54.5 ttt85 -49.95 -43.54 50.04 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 124.788 1.235 . . . . 0.0 110.613 -178.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 12.9 m-80 -86.63 -58.87 2.45 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 122.434 0.294 . . . . 0.0 111.054 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . 0.366 17.3 ptpt 48.19 -72.98 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 127.74 2.416 . . . . 0.0 113.295 -168.083 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -143.37 26.9 1.59 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.109 0.964 . . . . 0.0 111.131 176.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -128.75 142.21 51.07 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.796 0.838 . . . . 0.0 110.366 179.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 22.2 mp0 -69.89 151.8 45.25 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.314 1.046 . . . . 0.0 108.286 168.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.2 m -108.39 149.44 11.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 169.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 17.9 p30 -88.69 170.66 10.61 Favored 'General case' 0 C--O 1.23 0.077 0 C-N-CA 124.325 1.05 . . . . 0.0 110.832 175.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -38.58 -61.42 0.71 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.83 1.252 . . . . 0.0 113.74 174.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 40.8 tp60 -62.66 -38.75 91.54 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 120.025 1.284 . . . . 0.0 110.669 -174.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.85 -33.5 75.98 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.888 -0.507 . . . . 0.0 110.947 176.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -61.18 -53.27 59.11 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 118.841 0.746 . . . . 0.0 109.182 168.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 24.2 mm -52.24 -42.54 37.0 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 C-N-CA 122.844 0.458 . . . . 0.0 110.097 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 34.0 m -54.17 -37.76 64.81 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.049 0.54 . . . . 0.0 111.378 177.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -57.34 -50.18 73.78 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 176.026 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 51.5 mt -65.63 -43.65 88.86 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.186 0.595 . . . . 0.0 111.329 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.63 -43.41 97.97 Favored Glycine 0 CA--C 1.529 0.919 0 N-CA-C 110.945 -0.862 . . . . 0.0 110.945 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.81 -49.84 73.35 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 123.095 0.558 . . . . 0.0 110.383 175.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 16.4 tp -47.37 -56.48 6.81 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.401 0.619 . . . . 0.0 109.948 173.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.96 -53.57 39.77 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.555 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 9.2 mtm -57.46 -50.45 72.99 Favored 'General case' 0 N--CA 1.455 -0.203 0 O-C-N 123.327 0.392 . . . . 0.0 111.861 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 84.0 mt -63.41 -49.96 80.61 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-O 117.79 -1.1 . . . . 0.0 110.34 -174.139 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.467 0.4 OUTLIER -78.18 -40.36 37.97 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-N 120.256 1.389 . . . . 0.0 113.504 -178.508 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.0 m-80 -82.53 67.22 8.49 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 169.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 90.2 mt-10 -41.37 -42.64 2.29 Favored 'General case' 0 N--CA 1.461 0.099 0 C-N-CA 125.281 1.432 . . . . 0.0 112.12 -172.181 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -31.42 -52.75 0.22 Allowed 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 126.561 1.944 . . . . 0.0 113.372 171.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 63.8 mt -59.24 -24.08 62.89 Favored 'General case' 0 C--O 1.224 -0.256 0 C-N-CA 123.717 0.807 . . . . 0.0 113.103 -175.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -77.76 -15.07 59.37 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 119.522 1.055 . . . . 0.0 111.59 177.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.161 0 CA-C-O 117.205 -1.886 . . . . 0.0 111.185 -178.158 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 91.6 mmm . . . . . 0 N--CA 1.475 0.788 0 CA-C-O 120.404 0.145 . . . . 0.0 110.636 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -78.41 64.48 3.5 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 176.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.3 m -57.54 165.91 1.99 Allowed Pre-proline 0 CA--C 1.537 0.477 0 C-N-CA 125.082 1.353 . . . . 0.0 111.109 179.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 99.1 Cg_exo -45.45 -47.53 12.96 Favored 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 123.524 2.816 . . . . 0.0 113.477 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.9 mt -54.39 -55.53 27.7 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-N 117.817 0.28 . . . . 0.0 111.435 173.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -59.43 -39.67 84.27 Favored 'General case' 0 C--O 1.225 -0.22 0 N-CA-C 110.385 -0.228 . . . . 0.0 110.385 -176.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 12.4 tp-100 -63.37 -50.41 70.04 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.507 0.723 . . . . 0.0 110.501 177.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.28 -45.03 93.34 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.313 0.645 . . . . 0.0 111.095 -178.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 72.7 mt -53.14 -53.23 23.79 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 N-CA-C 108.107 -1.071 . . . . 0.0 108.107 169.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.43 -45.86 16.82 Favored Glycine 0 CA--C 1.526 0.751 0 C-N-CA 125.69 1.614 . . . . 0.0 112.176 175.328 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.7 mt -57.87 -55.99 27.8 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 117.751 0.776 . . . . 0.0 110.97 173.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.6 mp -58.69 -43.02 89.85 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.18 0.9 . . . . 0.0 111.608 -179.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 75.0 mt -54.12 -57.23 6.34 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 C-N-CA 124.09 0.956 . . . . 0.0 109.981 171.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.02 -50.44 58.91 Favored Glycine 0 CA--C 1.522 0.497 0 N-CA-C 110.249 -1.14 . . . . 0.0 110.249 -176.019 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 13.9 mm -51.56 -50.28 30.55 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 C-N-CA 123.523 0.729 . . . . 0.0 110.04 175.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -56.9 -57.72 11.26 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.252 178.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -56.72 -38.44 72.35 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.843 0.857 . . . . 0.0 111.139 -174.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -46.09 -39.14 8.93 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.601 1.161 . . . . 0.0 111.571 -179.342 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -107.2 -52.01 2.83 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 122.542 0.337 . . . . 0.0 110.11 178.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 5.6 m -52.72 -36.17 57.05 Favored 'General case' 0 CA--C 1.527 0.081 0 C-N-CA 123.573 0.749 . . . . 0.0 111.981 -177.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -41.15 -47.5 4.35 Favored Glycine 0 CA--C 1.527 0.832 0 C-N-CA 124.192 0.901 . . . . 0.0 111.834 172.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -65.87 -22.08 66.5 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 122.736 0.415 . . . . 0.0 111.847 -173.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 44.7 mm-40 -75.68 -7.52 54.53 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.692 0.397 . . . . 0.0 111.819 178.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 77.21 -63.74 3.23 Favored Glycine 0 CA--C 1.527 0.791 0 N-CA-C 110.302 -1.119 . . . . 0.0 110.302 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 60.4 t0 -78.08 65.32 3.45 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 170.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 60.8 pttt -69.34 12.18 0.19 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 125.474 1.51 . . . . 0.0 114.809 -169.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 19.9 t-160 -78.98 -23.87 44.2 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 124.691 1.196 . . . . 0.0 108.064 166.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 56.9 p -125.58 157.94 35.88 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 125.162 1.385 . . . . 0.0 111.968 -172.423 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.88 178.44 9.4 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 125.372 1.469 . . . . 0.0 107.703 168.109 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 4.3 m -135.5 173.31 11.86 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.412 0.685 . . . . 0.0 112.793 -170.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 37.2 ttmt -19.52 -68.86 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 130.44 3.496 . . . . 0.0 113.824 175.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 3.0 tppp? -56.08 -53.55 55.67 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.586 0.755 . . . . 0.0 109.959 -175.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -57.04 -41.71 79.15 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 123.516 0.726 . . . . 0.0 110.989 178.524 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 39.4 mt -61.47 -50.05 74.33 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 118.478 0.581 . . . . 0.0 111.212 178.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -59.55 -47.7 84.51 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 179.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -50.71 -55.91 14.42 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.314 0.646 . . . . 0.0 111.403 171.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 3.1 mt -45.43 -65.25 0.56 Allowed 'General case' 0 CA--C 1.521 -0.151 0 C-N-CA 124.514 1.126 . . . . 0.0 110.994 176.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 14.8 tt -61.19 -47.61 92.75 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 C-N-CA 120.056 -0.658 . . . . 0.0 109.827 -173.124 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -53.94 -50.12 67.16 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.016 0.926 . . . . 0.0 111.866 -178.948 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 50.9 mtmt -76.21 -49.48 17.04 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 122.359 0.264 . . . . 0.0 111.076 -176.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -78.02 -32.44 51.04 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 118.533 -0.746 . . . . 0.0 112.795 -169.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 48.7 mt -91.54 91.61 8.13 Favored 'General case' 0 C--N 1.338 0.089 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 169.013 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 62.2 p -75.83 62.76 1.59 Allowed 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 124.49 1.116 . . . . 0.0 108.867 178.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 64.7 mt -92.68 -65.08 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 C-N-CA 124.703 1.201 . . . . 0.0 108.284 -176.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.68 -67.53 0.78 Allowed Glycine 0 CA--C 1.53 1.004 0 N-CA-C 110.305 -1.118 . . . . 0.0 110.305 -174.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 19.8 m -67.3 75.74 0.15 Allowed 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 125.139 1.375 . . . . 0.0 109.707 170.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -39.62 93.28 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 127.012 2.125 . . . . 0.0 112.377 -177.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 90.5 mt -42.57 -54.99 3.7 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 125.62 1.568 . . . . 0.0 113.019 -173.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -162.34 157.76 23.15 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 -174.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -32.62 -45.5 0.12 Allowed 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 128.511 2.724 . . . . 0.0 113.886 -173.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -30.3 -55.7 0.19 Allowed 'General case' 0 C--O 1.227 -0.102 0 C-N-CA 125.907 1.683 . . . . 0.0 113.695 178.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -66.1 -42.17 89.63 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 121.069 0.461 . . . . 0.0 110.701 -174.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.1 mp -61.26 -52.97 55.22 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 N-CA-C 106.636 -1.616 . . . . 0.0 106.636 179.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 69.9 t -57.08 -43.72 81.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 C-N-CA 124.362 1.065 . . . . 0.0 110.233 -178.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -55.92 -54.78 40.56 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 119.418 1.008 . . . . 0.0 110.497 172.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 43.5 mt -53.36 -42.09 66.49 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 119.04 -0.505 . . . . 0.0 111.359 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 22.9 mmt -68.76 -61.86 1.63 Allowed 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 118.741 0.701 . . . . 0.0 109.613 177.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -40.94 -46.98 2.92 Favored 'General case' 0 CA--C 1.516 -0.333 0 C-N-CA 127.626 2.37 . . . . 0.0 111.113 -177.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -39.71 -49.22 2.26 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.071 0.949 . . . . 0.0 112.513 177.377 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 10.0 mp -59.74 -56.02 27.05 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -177.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -61.27 -40.87 95.7 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 123.444 0.698 . . . . 0.0 111.245 -178.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 52.5 ttt180 -62.94 -50.54 70.4 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 124.035 0.934 . . . . 0.0 109.798 -178.559 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 -73.71 -50.33 21.36 Favored 'General case' 0 C--O 1.227 -0.082 0 N-CA-C 110.586 -0.153 . . . . 0.0 110.586 -176.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 50.9 mttp 62.69 -80.98 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.498 1.119 . . . . 0.0 108.938 -168.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -153.49 36.8 0.46 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 126.301 1.84 . . . . 0.0 108.866 170.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -124.26 139.01 54.32 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 125.588 1.555 . . . . 0.0 108.031 -175.592 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -68.54 159.0 32.7 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.852 0.861 . . . . 0.0 110.378 174.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 12.0 m -115.67 148.03 18.67 Favored 'Isoleucine or valine' 0 C--O 1.235 0.303 0 N-CA-C 107.062 -1.459 . . . . 0.0 107.062 168.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -89.39 177.6 6.54 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.542 0.737 . . . . 0.0 111.287 175.251 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -47.35 -60.02 2.8 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.623 0.769 . . . . 0.0 111.94 175.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 40.3 tp60 -58.9 -37.93 77.75 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 119.218 0.917 . . . . 0.0 111.264 -176.029 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -63.26 -42.79 99.18 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.502 -0.749 . . . . 0.0 111.032 176.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -55.67 -48.59 74.79 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.64 -0.663 . . . . 0.0 109.915 170.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 28.0 mm -59.05 -32.47 47.89 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 O-C-N 121.601 -0.687 . . . . 0.0 110.76 175.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 23.4 m -66.37 -41.75 88.99 Favored 'General case' 0 C--O 1.225 -0.189 0 O-C-N 121.265 -0.897 . . . . 0.0 109.822 174.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -56.3 -52.92 62.74 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 174.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 49.2 mt -60.07 -46.13 90.59 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 120.933 0.397 . . . . 0.0 111.664 177.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.28 -39.2 97.58 Favored Glycine 0 CA--C 1.525 0.662 0 N-CA-C 110.948 -0.861 . . . . 0.0 110.948 -176.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.33 -47.14 77.54 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.431 0.692 . . . . 0.0 110.175 174.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 14.5 tp -51.33 -54.36 27.03 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 175.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.83 -57.33 9.65 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 114.872 -1.058 . . . . 0.0 109.995 177.532 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 49.5 ttm -48.09 -51.14 25.74 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.785 0.834 . . . . 0.0 110.755 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 33.6 mt -69.91 -48.49 63.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-O 117.859 -1.067 . . . . 0.0 111.201 -172.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.426 0.0 OUTLIER -87.99 -34.74 17.94 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 115.157 1.54 . . . . 0.0 115.157 -176.593 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 33.4 m120 -80.0 68.6 6.16 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 172.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -33.55 -43.79 0.13 Allowed 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 127.725 2.41 . . . . 0.0 114.364 -174.136 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -40.5 -41.5 1.44 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.572 1.549 . . . . 0.0 113.038 176.266 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 96.0 mt -62.4 -28.32 69.7 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -179.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 57.7 mtmt -89.06 -47.2 8.28 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.559 0.743 . . . . 0.0 109.401 172.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.143 0 CA-C-O 117.489 -1.728 . . . . 0.0 110.035 179.395 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.2 ttt . . . . . 0 N--CA 1.474 0.731 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -71.62 80.05 0.82 Allowed 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 122.88 0.472 . . . . 0.0 110.892 -175.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -54.86 161.57 2.25 Favored Pre-proline 0 CA--C 1.542 0.636 0 C-N-CA 124.012 0.925 . . . . 0.0 111.093 173.192 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -48.94 -49.26 15.59 Favored 'Trans proline' 0 N--CA 1.458 -0.592 0 C-N-CA 123.009 2.472 . . . . 0.0 112.424 177.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.6 mt -58.45 -45.54 88.35 Favored 'General case' 0 C--O 1.223 -0.309 0 CA-C-O 118.985 -0.531 . . . . 0.0 111.013 175.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -57.86 -46.09 85.33 Favored 'General case' 0 C--O 1.227 -0.111 0 CA-C-N 118.771 0.714 . . . . 0.0 109.758 -178.601 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 12.5 tp60 -61.17 -49.07 78.71 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 122.05 0.14 . . . . 0.0 111.052 177.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.12 -46.91 79.06 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 121.503 0.668 . . . . 0.0 111.474 -175.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 76.9 mt -53.74 -53.56 25.53 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.233 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 170.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -45.96 -47.41 14.53 Favored Glycine 0 CA--C 1.528 0.857 0 C-N-CA 124.78 1.181 . . . . 0.0 111.807 175.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.2 mt -55.94 -57.18 13.2 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.22 0.608 . . . . 0.0 110.963 173.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.5 mp -57.44 -43.78 84.17 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.26 0.937 . . . . 0.0 111.899 -178.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 63.6 mt -55.01 -57.93 5.61 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 C-N-CA 123.627 0.771 . . . . 0.0 109.814 172.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -53.72 -49.95 55.93 Favored Glycine 0 CA--C 1.522 0.518 0 N-CA-C 110.411 -1.076 . . . . 0.0 110.411 -176.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 11.7 mm -52.62 -49.59 44.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 C-N-CA 123.581 0.752 . . . . 0.0 110.318 175.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -56.72 -57.42 12.5 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 118.307 0.503 . . . . 0.0 110.147 177.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -59.18 -37.09 76.54 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 123.549 0.74 . . . . 0.0 111.388 -172.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -46.64 -40.84 13.76 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 124.738 1.215 . . . . 0.0 111.41 178.22 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -96.55 -59.44 1.82 Allowed 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 176.686 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.4 m -47.87 -42.25 26.28 Favored 'General case' 0 CA--C 1.527 0.082 0 C-N-CA 123.984 0.914 . . . . 0.0 112.273 -171.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -38.77 -48.48 2.45 Favored Glycine 0 C--N 1.341 0.828 0 C-N-CA 124.606 1.098 . . . . 0.0 112.207 176.213 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.27 -30.98 71.51 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 122.821 0.449 . . . . 0.0 111.486 -172.319 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.2 mp0 -80.15 0.17 33.41 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 119.115 -0.469 . . . . 0.0 111.986 -176.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 78.06 -61.92 3.72 Favored Glycine 0 CA--C 1.527 0.827 0 CA-C-N 119.383 0.992 . . . . 0.0 110.825 174.091 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 55.8 t0 -78.38 60.49 2.59 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 170.222 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 23.5 pttm -69.62 8.62 0.62 Allowed 'General case' 0 N--CA 1.457 -0.104 0 C-N-CA 126.846 2.058 . . . . 0.0 114.333 -169.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 4.7 m80 -80.03 -19.43 47.69 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 126.172 1.789 . . . . 0.0 108.871 170.007 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.2 p -132.65 158.67 41.69 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 127.722 2.409 . . . . 0.0 110.374 -177.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.34 178.61 9.42 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 125.471 1.509 . . . . 0.0 107.38 168.532 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 7.3 t -134.39 -168.5 2.15 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.462 1.028 . . . . 0.0 113.675 -174.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 21.2 pttt -48.81 -53.3 19.77 Favored 'General case' 0 C--O 1.228 -0.06 0 C-N-CA 126.146 1.778 . . . . 0.0 115.001 -168.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -54.05 -47.69 71.36 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 118.795 0.725 . . . . 0.0 109.961 179.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -63.03 -39.93 96.21 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 123.281 0.632 . . . . 0.0 110.79 178.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.1 mp -61.6 -49.08 78.03 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.901 0.773 . . . . 0.0 112.192 174.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -56.02 -47.79 77.16 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 176.62 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -54.78 -57.04 13.13 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-O 119.148 -0.453 . . . . 0.0 111.168 173.232 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.6 mt -46.42 -60.49 2.31 Favored 'General case' 0 C--N 1.333 -0.136 0 C-N-CA 123.836 0.854 . . . . 0.0 110.333 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 13.5 tt -62.72 -50.86 78.03 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 C-N-CA 120.44 -0.504 . . . . 0.0 109.879 -176.034 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -59.94 -47.42 85.85 Favored 'General case' 0 CA--C 1.537 0.471 0 O-C-N 121.152 -0.967 . . . . 0.0 112.235 -175.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -76.13 -55.93 5.13 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.819 -0.551 . . . . 0.0 109.707 -177.356 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -84.77 -19.38 32.68 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 -168.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 30.3 mt -117.02 61.93 0.73 Allowed 'General case' 0 N--CA 1.461 0.096 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 169.328 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 64.5 p -34.89 -72.73 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 126.691 1.997 . . . . 0.0 112.169 -176.034 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 87.3 mt 64.44 -67.22 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 C-N-CA 127.002 2.121 . . . . 0.0 113.186 170.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.34 -65.47 1.31 Allowed Glycine 0 CA--C 1.529 0.919 0 N-CA-C 110.125 -1.19 . . . . 0.0 110.125 -171.079 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 17.5 m -68.14 74.81 0.22 Allowed 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 125.594 1.558 . . . . 0.0 111.019 175.283 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 41.5 mmtm -34.69 92.67 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 127.696 2.398 . . . . 0.0 112.331 -179.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 80.9 mt -59.78 109.77 1.0 Allowed 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.79 0.836 . . . . 0.0 113.114 -169.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 63.12 -77.36 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 126.163 1.785 . . . . 0.0 113.471 167.053 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -167.93 -47.43 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 124.156 0.982 . . . . 0.0 109.59 -169.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -36.13 -58.99 0.64 Allowed 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 125.078 1.351 . . . . 0.0 112.581 -179.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 87.7 tt0 -61.4 -39.76 91.89 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.942 0.897 . . . . 0.0 111.388 -176.42 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -65.2 -54.58 27.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 106.45 -1.685 . . . . 0.0 106.45 -176.552 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 78.5 t -56.76 -42.18 76.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.046 177.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.8 mptp? -55.89 -54.31 46.24 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 119.091 0.86 . . . . 0.0 110.607 175.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 27.5 mt -53.26 -39.3 63.78 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 119.369 -0.348 . . . . 0.0 111.503 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.89 -62.66 1.42 Allowed 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 118.537 0.608 . . . . 0.0 110.078 177.208 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -43.33 -40.14 3.45 Favored 'General case' 0 CA--C 1.523 -0.074 0 C-N-CA 127.062 2.145 . . . . 0.0 111.987 -178.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -39.81 -47.82 2.17 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.303 1.041 . . . . 0.0 112.736 173.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.8 mp -66.49 -34.15 77.28 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 122.898 0.479 . . . . 0.0 110.901 -179.011 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -74.41 -51.93 13.56 Favored 'General case' 0 N--CA 1.456 -0.128 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 -179.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 17.4 mtp85 -44.39 -56.29 4.34 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.624 0.77 . . . . 0.0 109.231 170.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -93.05 37.33 1.03 Allowed 'General case' 0 C--O 1.234 0.25 0 C-N-CA 122.964 0.506 . . . . 0.0 111.502 -178.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 20.0 ttmm -74.42 72.8 1.87 Allowed 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 172.28 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 69.92 42.2 1.06 Allowed 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 126.801 2.04 . . . . 0.0 111.648 -171.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -134.28 161.48 34.83 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 108.477 -0.935 . . . . 0.0 108.477 168.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -113.5 131.76 55.94 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 105.11 -2.182 . . . . 0.0 105.11 166.327 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 11.6 m -86.34 135.59 24.73 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 -178.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -79.8 171.03 15.67 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 123.731 0.812 . . . . 0.0 111.027 176.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -42.51 -59.52 1.85 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.502 0.721 . . . . 0.0 112.831 176.065 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.2 tp60 -63.85 -33.52 75.87 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 120.9 -1.125 . . . . 0.0 111.113 -175.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -64.81 -41.84 95.47 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 121.385 -0.822 . . . . 0.0 110.779 174.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -55.94 -50.59 70.35 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.414 -0.804 . . . . 0.0 109.38 170.242 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.1 mm -56.66 -37.94 55.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 O-C-N 121.922 -0.486 . . . . 0.0 110.451 176.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 33.2 m -62.63 -39.44 93.85 Favored 'General case' 0 C--O 1.226 -0.137 0 CA-C-N 118.95 0.796 . . . . 0.0 110.013 176.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -55.19 -53.97 49.22 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 173.004 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 53.5 mt -60.91 -45.16 95.74 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 122.04 -0.413 . . . . 0.0 112.017 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.35 -45.34 91.08 Favored Glycine 0 CA--C 1.524 0.616 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 -176.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.51 -45.51 92.66 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 117.691 0.745 . . . . 0.0 110.187 175.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 12.7 tp -51.87 -56.02 16.55 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 118.488 0.585 . . . . 0.0 109.786 174.743 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.06 -53.32 34.86 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.332 1.053 . . . . 0.0 110.669 178.381 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 44.6 ttm -55.55 -50.76 69.18 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 125.082 1.353 . . . . 0.0 110.757 -179.05 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 62.8 mt -65.92 -53.34 39.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-O 118.454 -0.784 . . . . 0.0 110.265 -175.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.473 0.1 OUTLIER -74.54 -37.55 63.01 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-N 119.739 1.154 . . . . 0.0 113.126 -176.057 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 25.0 m-80 -82.66 61.55 5.82 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 168.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.71 -37.06 3.46 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.88 1.272 . . . . 0.0 112.332 -174.518 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -31.96 -48.36 0.16 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 127.699 2.4 . . . . 0.0 113.306 169.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 46.2 mt -54.66 -33.25 60.45 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 -177.193 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 9.0 mtmp? -77.01 63.06 2.25 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.868 0.758 . . . . 0.0 111.72 -172.217 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.162 0 CA-C-O 117.3 -1.834 . . . . 0.0 111.025 172.929 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 26.9 ptm . . . . . 0 N--CA 1.471 0.607 0 N-CA-C 110.761 -0.088 . . . . 0.0 110.761 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.6 72.02 0.5 Allowed 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.895 0.878 . . . . 0.0 110.746 -178.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 10.5 m -62.76 163.5 15.62 Favored Pre-proline 0 CA--C 1.538 0.484 0 C-N-CA 125.871 1.668 . . . . 0.0 109.206 178.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -48.14 -48.33 16.92 Favored 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 122.921 2.414 . . . . 0.0 113.006 -176.521 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.8 mt -53.73 -52.54 59.81 Favored 'General case' 0 C--O 1.225 -0.192 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 172.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -61.57 -38.74 88.62 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-N 118.063 0.392 . . . . 0.0 110.565 -176.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.2 tp-100 -62.82 -50.9 69.16 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.291 0.636 . . . . 0.0 110.213 176.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.67 -45.93 91.89 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.44 0.638 . . . . 0.0 111.193 -179.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 67.4 mt -53.44 -51.24 43.33 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 170.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -48.59 -47.73 29.38 Favored Glycine 0 CA--C 1.525 0.713 0 C-N-CA 125.359 1.456 . . . . 0.0 111.619 175.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 mt -54.88 -55.21 32.95 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 117.525 0.662 . . . . 0.0 110.651 173.137 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -57.07 -43.6 82.26 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.007 0.822 . . . . 0.0 111.616 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 94.6 mt -56.07 -55.55 17.76 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 C-N-CA 123.487 0.715 . . . . 0.0 110.091 173.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.09 -48.49 73.52 Favored Glycine 0 CA--C 1.523 0.588 0 N-CA-C 110.802 -0.919 . . . . 0.0 110.802 -178.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.5 mm -53.58 -47.53 60.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 C-N-CA 123.183 0.593 . . . . 0.0 110.011 175.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -56.36 -57.37 12.55 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.476 0.58 . . . . 0.0 109.543 175.048 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -52.49 -40.17 62.06 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 125.491 1.516 . . . . 0.0 112.113 -173.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 65.0 tttp -50.96 -34.71 29.98 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.128 1.371 . . . . 0.0 111.467 176.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 71.5 m-85 -101.96 -60.89 1.46 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.615 0.766 . . . . 0.0 110.806 179.103 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 5.0 p -80.39 -61.85 1.85 Allowed 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 123.335 0.654 . . . . 0.0 110.743 -174.528 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -47.26 -37.12 10.98 Favored Glycine 0 CA--C 1.526 0.741 0 C-N-CA 125.425 1.488 . . . . 0.0 114.593 -169.074 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -65.13 -31.57 72.83 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 118.206 1.003 . . . . 0.0 112.609 177.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -75.03 161.26 29.6 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.538 1.135 . . . . 0.0 109.422 177.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -55.19 -47.2 75.64 Favored Glycine 0 CA--C 1.531 1.089 0 O-C-N 121.987 -0.446 . . . . 0.0 112.242 -178.326 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -79.79 60.81 3.54 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.84 0.856 . . . . 0.0 110.314 -177.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 24.5 mtmm -48.2 -33.59 8.76 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.379 1.072 . . . . 0.0 113.883 -169.539 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 9.5 t-80 -77.98 -10.83 59.78 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -172.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 4.8 p -136.58 162.46 33.06 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.898 0.879 . . . . 0.0 112.89 -168.195 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -161.34 174.24 13.81 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.695 1.198 . . . . 0.0 109.255 168.103 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -115.41 171.83 7.47 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.054 0.941 . . . . 0.0 112.832 -169.662 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 14.3 ptmt -35.93 -57.98 0.66 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 127.521 2.328 . . . . 0.0 114.414 179.295 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.17 -45.43 87.49 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 122.805 0.442 . . . . 0.0 110.118 -178.144 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -62.87 -39.42 94.39 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 123.299 0.64 . . . . 0.0 110.936 177.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 5.9 mt -61.41 -49.82 75.31 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 119.096 0.862 . . . . 0.0 111.849 173.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 89.3 mttt -55.52 -46.84 76.98 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 122.114 -0.366 . . . . 0.0 110.266 176.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -54.62 -55.06 33.4 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 118.856 -0.592 . . . . 0.0 110.915 173.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 8.3 mt -46.38 -61.38 1.82 Allowed 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.295 0.638 . . . . 0.0 110.43 179.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 18.4 tt -59.62 -54.5 33.71 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 119.916 -0.713 . . . . 0.0 110.156 -176.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -60.79 -46.11 91.79 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 118.606 0.639 . . . . 0.0 112.673 -173.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -74.8 -52.75 10.62 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.13 0.572 . . . . 0.0 109.626 -177.474 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 55.4 mm-40 -81.96 -27.52 33.21 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -167.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 41.0 mt -104.94 95.08 5.62 Favored 'General case' 0 CA--C 1.523 -0.083 0 N-CA-C 105.114 -2.18 . . . . 0.0 105.114 167.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 66.9 p -77.39 58.11 1.63 Allowed 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.366 1.066 . . . . 0.0 109.818 -172.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 65.6 mt -105.61 76.94 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.643 0 N-CA-C 106.544 -1.65 . . . . 0.0 106.544 -172.712 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.43 -53.12 46.71 Favored Glycine 0 CA--C 1.528 0.854 0 N-CA-C 108.632 -1.787 . . . . 0.0 108.632 169.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 6.7 m -66.96 80.4 0.12 Allowed 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.54 1.136 . . . . 0.0 109.97 171.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 43.8 mmtm -46.95 92.94 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.99 1.716 . . . . 0.0 111.359 177.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 95.0 mt -50.88 -53.99 27.75 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 124.419 1.088 . . . . 0.0 112.433 -170.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -162.72 155.51 19.36 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 -170.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -19.96 -51.16 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 129.798 3.239 . . . . 0.0 115.367 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.84 -60.97 0.16 Allowed 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 125.912 1.685 . . . . 0.0 113.35 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -66.15 -39.83 90.11 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 120.792 0.33 . . . . 0.0 110.954 -174.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -61.06 -57.6 11.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 -177.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 52.5 t -57.77 -39.39 70.48 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 CA-C-N 115.01 -0.995 . . . . 0.0 110.187 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -56.17 -52.14 65.45 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 119.794 1.179 . . . . 0.0 111.229 174.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 68.1 mt -55.38 -40.54 71.48 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 119.345 -0.359 . . . . 0.0 111.205 -179.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.47 -60.69 2.1 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 118.839 0.745 . . . . 0.0 110.132 176.366 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -40.46 -46.13 2.37 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 127.369 2.268 . . . . 0.0 111.7 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -39.55 -48.23 2.02 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.449 1.1 . . . . 0.0 112.112 175.423 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 63.2 mt -57.9 -50.83 72.0 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.508 0.723 . . . . 0.0 110.017 -179.232 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -67.21 -41.16 86.23 Favored 'General case' 0 C--O 1.226 -0.15 0 C-N-CA 123.194 0.598 . . . . 0.0 111.067 -178.38 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 53.3 ttm-85 -60.01 -48.21 82.64 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.464 1.106 . . . . 0.0 109.977 -179.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -79.63 -48.32 13.95 Favored 'General case' 0 C--O 1.228 -0.051 0 CA-C-O 120.703 0.287 . . . . 0.0 111.316 -177.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 48.1 mttm 61.84 -87.56 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 124.788 1.235 . . . . 0.0 107.741 -167.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -150.82 41.07 0.75 Allowed 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 125.511 1.524 . . . . 0.0 108.577 169.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 19.5 mm-40 -131.43 151.26 51.7 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 125.589 1.555 . . . . 0.0 107.392 172.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 44.9 mp0 -77.49 143.89 38.14 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 124.408 1.083 . . . . 0.0 109.874 -178.135 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 35.6 m -86.27 154.94 3.38 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 168.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 16.3 p30 -97.93 171.13 8.48 Favored 'General case' 0 CA--C 1.528 0.111 0 C-N-CA 124.797 1.239 . . . . 0.0 111.425 176.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -41.59 -60.98 1.16 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.402 1.081 . . . . 0.0 113.16 175.083 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 41.1 tp60 -63.51 -34.0 76.82 Favored 'General case' 0 C--O 1.225 -0.211 0 O-C-N 121.036 -1.04 . . . . 0.0 110.879 -175.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 54.7 mm-40 -63.01 -45.43 92.4 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 118.932 0.787 . . . . 0.0 111.17 173.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -53.67 -50.03 66.7 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.697 -0.627 . . . . 0.0 109.846 171.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 27.1 mm -58.01 -38.42 66.92 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 O-C-N 121.855 -0.528 . . . . 0.0 110.652 176.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 70.7 m -63.11 -41.71 99.4 Favored 'General case' 0 C--O 1.226 -0.174 0 O-C-N 121.506 -0.746 . . . . 0.0 109.972 176.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -56.37 -54.28 47.48 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 174.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 42.2 mt -58.82 -47.65 84.04 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 121.975 -0.453 . . . . 0.0 112.032 178.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.75 -43.94 97.02 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 110.87 -0.892 . . . . 0.0 110.87 -176.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.07 -48.26 79.42 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 121.988 -0.713 . . . . 0.0 110.205 176.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -49.56 -56.83 8.53 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-O 121.864 0.84 . . . . 0.0 109.88 173.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.94 -54.54 23.37 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 114.612 -1.176 . . . . 0.0 110.376 179.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 19.7 ttp -62.4 -45.57 92.52 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 123.596 0.758 . . . . 0.0 111.648 -177.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 75.4 mt -60.66 -47.88 91.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.012 -177.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.484 0.0 OUTLIER -82.45 -34.16 28.25 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 114.476 1.287 . . . . 0.0 114.476 -179.926 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -80.6 75.05 7.5 Favored 'General case' 0 N--CA 1.462 0.159 0 O-C-N 120.779 -1.201 . . . . 0.0 108.505 171.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -40.41 -37.99 0.76 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.834 1.654 . . . . 0.0 112.977 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -39.93 -42.3 1.32 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.527 1.531 . . . . 0.0 113.46 173.33 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 93.9 mt -76.76 -12.34 59.97 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.763 0.825 . . . . 0.0 113.029 -176.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 9.9 mtmp? -100.41 -45.12 5.67 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 124.334 1.054 . . . . 0.0 110.263 174.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.124 0 CA-C-O 117.484 -1.731 . . . . 0.0 110.273 -178.518 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.8 mtm . . . . . 0 N--CA 1.474 0.762 0 N-CA-C 110.778 -0.082 . . . . 0.0 110.778 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 48.3 68.74 0.64 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 124.82 1.248 . . . . 0.0 111.972 179.075 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -50.32 158.33 1.03 Allowed Pre-proline 0 CA--C 1.54 0.586 0 C-N-CA 124.702 1.201 . . . . 0.0 111.541 177.314 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_exo -44.67 -49.89 8.89 Favored 'Trans proline' 0 N--CA 1.46 -0.491 0 C-N-CA 123.501 2.801 . . . . 0.0 113.404 -179.542 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.2 mt -55.9 -48.96 74.71 Favored 'General case' 0 C--O 1.226 -0.164 0 O-C-N 122.427 -0.17 . . . . 0.0 111.316 174.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -59.77 -46.9 87.75 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -177.376 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 12.2 tp60 -59.92 -47.27 86.47 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 122.505 0.322 . . . . 0.0 110.736 177.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.59 -46.04 77.25 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.091 0.472 . . . . 0.0 111.412 -176.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 77.9 mt -54.2 -50.66 54.06 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 170.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.46 -48.14 22.14 Favored Glycine 0 CA--C 1.528 0.89 0 C-N-CA 124.966 1.27 . . . . 0.0 111.893 174.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.9 mt -55.52 -56.8 16.02 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 117.71 0.755 . . . . 0.0 110.553 174.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.6 mp -57.98 -43.46 86.56 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 119.018 0.826 . . . . 0.0 111.752 -178.108 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 73.5 mt -55.48 -56.53 11.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 C-N-CA 124.03 0.932 . . . . 0.0 110.356 173.255 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.58 -49.33 65.74 Favored Glycine 0 CA--C 1.523 0.542 0 N-CA-C 110.544 -1.022 . . . . 0.0 110.544 -177.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 8.7 mm -54.03 -48.44 64.39 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 C-N-CA 123.674 0.79 . . . . 0.0 110.148 176.099 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -54.98 -61.4 2.33 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 118.45 0.568 . . . . 0.0 109.525 176.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -53.42 -39.32 64.27 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.583 0.753 . . . . 0.0 111.633 -174.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -50.64 -36.77 37.01 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.842 0.857 . . . . 0.0 111.734 178.161 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -101.12 -53.37 3.04 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.306 0.642 . . . . 0.0 110.028 -178.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m -54.82 -32.59 60.57 Favored 'General case' 0 CA--C 1.529 0.144 0 O-C-N 121.322 -0.861 . . . . 0.0 111.907 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -44.53 -34.14 3.49 Favored Glycine 0 CA--C 1.531 1.054 0 CA-C-O 118.74 -1.033 . . . . 0.0 113.528 173.113 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 5.7 ptmm? -104.54 29.54 6.06 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.581 1.19 . . . . 0.0 112.876 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -115.29 149.83 37.21 Favored 'General case' 0 C--O 1.225 -0.231 0 N-CA-C 107.442 -1.318 . . . . 0.0 107.442 169.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -53.9 -64.99 3.75 Favored Glycine 0 CA--C 1.529 0.964 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 -175.214 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -79.92 86.0 5.48 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 169.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -57.05 -11.43 1.54 Allowed 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 -174.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 24.1 m80 -78.94 -5.07 52.82 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.094 0.957 . . . . 0.0 111.568 174.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 48.0 p -133.92 168.22 19.17 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.073 1.349 . . . . 0.0 109.379 -178.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -154.79 159.04 40.35 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 122.631 0.372 . . . . 0.0 111.463 169.617 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 81.0 p -103.38 167.12 10.01 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.782 0.833 . . . . 0.0 112.936 -169.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.0 pttm -32.98 -48.69 0.21 Allowed 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 127.158 2.183 . . . . 0.0 113.987 170.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.5 tmmm? -60.1 -52.23 66.25 Favored 'General case' 0 N--CA 1.453 -0.311 0 O-C-N 121.969 -0.457 . . . . 0.0 109.9 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -61.08 -36.35 79.41 Favored 'General case' 0 C--O 1.223 -0.311 0 CA-C-O 119.346 -0.359 . . . . 0.0 110.776 178.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 48.6 mt -67.99 -49.9 58.86 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.575 0.625 . . . . 0.0 111.659 179.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp -60.46 -39.71 88.56 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 121.912 -0.493 . . . . 0.0 109.972 176.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -56.88 -63.96 1.03 Allowed 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 169.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.7 mt -39.49 -58.64 1.23 Allowed 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 125.212 1.405 . . . . 0.0 112.266 -178.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 16.0 tt -58.61 -51.37 72.63 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 -177.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -59.26 -42.01 90.15 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 120.995 -1.065 . . . . 0.0 112.718 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.1 mmpt? -77.7 -49.53 14.27 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 125.256 1.423 . . . . 0.0 110.694 -170.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -102.77 -24.05 13.75 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.914 1.286 . . . . 0.0 112.709 -168.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 69.5 mt -110.7 60.57 0.61 Allowed 'General case' 0 CA--C 1.527 0.064 0 N-CA-C 107.384 -1.339 . . . . 0.0 107.384 169.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 32.3 p -51.11 -54.33 26.09 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.529 0.731 . . . . 0.0 109.831 -178.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 80.9 mt 61.4 -64.13 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 C-N-CA 126.906 2.082 . . . . 0.0 113.242 174.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.25 -66.87 1.86 Allowed Glycine 0 CA--C 1.525 0.672 0 N-CA-C 109.861 -1.295 . . . . 0.0 109.861 -177.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 10.0 m -68.13 74.88 0.22 Allowed 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 124.523 1.129 . . . . 0.0 109.509 170.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 30.4 mmtp -44.21 93.75 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 126.16 1.784 . . . . 0.0 110.799 179.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 91.3 mt -49.4 -58.77 4.53 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 125.096 1.358 . . . . 0.0 112.609 -168.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -166.04 157.72 13.91 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 107.519 -1.289 . . . . 0.0 107.519 -175.304 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -30.25 -46.6 0.07 Allowed 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 128.901 2.881 . . . . 0.0 113.808 -174.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.27 -54.89 0.14 Allowed 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.948 1.699 . . . . 0.0 113.357 177.038 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 74.4 tt0 -67.29 -42.98 82.86 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.482 0.658 . . . . 0.0 111.031 -175.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 1.1 mp -62.22 -50.6 79.33 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 N-CA-C 106.565 -1.643 . . . . 0.0 106.565 -178.242 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 77.1 t -54.09 -56.25 10.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 N-CA-C 109.09 -0.708 . . . . 0.0 109.09 176.422 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.9 mptt -45.23 -52.54 9.38 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 123.235 0.614 . . . . 0.0 112.317 -179.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 15.3 mt -50.07 -42.31 49.68 Favored 'General case' 0 CA--C 1.535 0.378 0 O-C-N 123.194 0.309 . . . . 0.0 111.815 -179.068 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 1.2 mpp? -81.39 -66.15 0.92 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.694 0.798 . . . . 0.0 109.642 179.149 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -40.29 -37.73 0.69 Allowed 'General case' 0 N--CA 1.461 0.093 0 C-N-CA 127.503 2.321 . . . . 0.0 112.789 -178.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -38.45 -53.37 1.55 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.939 0.896 . . . . 0.0 112.124 172.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -60.51 -37.1 80.04 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 110.564 -0.162 . . . . 0.0 110.564 -175.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -73.82 -51.53 16.03 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.624 0.77 . . . . 0.0 109.83 -177.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.7 -31.51 72.76 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 120.435 0.159 . . . . 0.0 111.001 -177.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -73.03 -68.03 0.52 Allowed 'General case' 0 C--O 1.231 0.1 0 O-C-N 121.686 -0.634 . . . . 0.0 109.786 171.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt 62.44 -72.82 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.062 1.745 . . . . 0.0 109.332 -168.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -131.88 -18.24 2.72 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.674 1.59 . . . . 0.0 111.869 172.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 19.0 tt0 -67.87 110.7 3.96 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.564 0.746 . . . . 0.0 110.823 -173.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 51.6 mp0 -68.23 114.86 7.07 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 105.429 -2.063 . . . . 0.0 105.429 167.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.0 m -79.05 138.03 20.78 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 -169.707 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -79.82 171.89 14.51 Favored 'General case' 0 C--O 1.231 0.113 0 C-N-CA 122.685 0.394 . . . . 0.0 110.577 176.465 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -43.95 -56.93 3.61 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.623 0.769 . . . . 0.0 112.673 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 34.8 tp60 -63.73 -33.71 76.25 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 120.968 -1.083 . . . . 0.0 110.789 -176.025 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -66.62 -42.01 87.48 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 118.761 0.709 . . . . 0.0 110.641 176.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -54.69 -48.59 72.25 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 121.653 -0.654 . . . . 0.0 109.813 169.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.449 ' CG2' ' CG2' ' B' ' 74' ' ' ILE . 24.4 mm -62.51 -29.75 47.56 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 O-C-N 121.828 -0.545 . . . . 0.0 111.275 175.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 39.1 m -68.23 -43.7 77.35 Favored 'General case' 0 C--O 1.225 -0.205 0 O-C-N 120.922 -1.112 . . . . 0.0 109.496 173.739 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 58.1 t80 -56.28 -58.06 9.6 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 175.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 71.1 mt -61.3 -44.48 97.15 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 122.101 -0.374 . . . . 0.0 111.79 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.78 -44.03 95.37 Favored Glycine 0 CA--C 1.527 0.811 0 N-CA-C 111.071 -0.812 . . . . 0.0 111.071 -176.704 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.12 -47.92 75.46 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 117.798 0.799 . . . . 0.0 109.938 176.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 37.6 tp -47.11 -57.31 5.23 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 121.786 0.803 . . . . 0.0 110.226 172.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -53.38 -49.51 67.06 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 114.633 -1.167 . . . . 0.0 110.904 177.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 44.9 ttm -57.68 -51.23 70.37 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.171 0.988 . . . . 0.0 110.689 -179.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 65.4 mt -61.32 -50.71 79.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-O 118.287 -0.863 . . . . 0.0 109.577 -176.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.431 1.7 p90 -72.89 -40.79 65.3 Favored 'General case' 0 C--N 1.347 0.469 0 C-N-CA 118.818 -1.153 . . . . 0.0 113.301 -177.464 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 43.7 m-80 -78.81 74.85 5.33 Favored 'General case' 0 N--CA 1.462 0.135 0 O-C-N 121.077 -1.015 . . . . 0.0 108.634 172.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -39.56 -41.55 1.03 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.525 1.53 . . . . 0.0 113.074 -179.187 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -38.37 -46.41 1.12 Allowed 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.349 1.46 . . . . 0.0 112.885 173.114 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.0 mt -72.16 6.11 2.39 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.315 1.046 . . . . 0.0 113.367 -175.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt -111.73 3.68 17.95 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.218 1.007 . . . . 0.0 110.63 169.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.201 0 CA-C-O 117.29 -1.839 . . . . 0.0 110.231 -179.217 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 76.0 mtp . . . . . 0 N--CA 1.474 0.742 0 CA-C-O 120.547 0.213 . . . . 0.0 110.476 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.14 73.53 3.72 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 122.164 -0.335 . . . . 0.0 110.633 -178.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 2.9 m -52.83 159.41 1.81 Allowed Pre-proline 0 CA--C 1.542 0.655 0 C-N-CA 123.56 0.744 . . . . 0.0 110.976 171.609 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -49.02 -50.08 13.66 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 123.067 2.512 . . . . 0.0 113.099 -177.255 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.3 mt -55.56 -45.07 77.33 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 173.117 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -64.21 -38.57 91.52 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 118.35 0.523 . . . . 0.0 109.868 -176.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 14.2 tp60 -64.43 -46.75 81.87 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.542 0.337 . . . . 0.0 110.838 174.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.39 -47.87 80.24 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.539 0.685 . . . . 0.0 110.989 -178.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 74.6 mt -53.35 -51.95 36.19 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 169.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.66 -43.48 21.99 Favored Glycine 0 CA--C 1.526 0.773 0 C-N-CA 125.717 1.627 . . . . 0.0 112.109 175.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 mt -59.38 -54.15 50.04 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 117.704 0.752 . . . . 0.0 110.598 173.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.7 mp -58.23 -43.66 87.85 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 118.814 0.734 . . . . 0.0 111.341 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 76.3 mt -56.03 -55.93 15.63 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.157 0 C-N-CA 123.825 0.85 . . . . 0.0 109.921 173.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -53.97 -50.61 54.22 Favored Glycine 0 CA--C 1.521 0.445 0 N-CA-C 110.023 -1.231 . . . . 0.0 110.023 -177.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 8.6 mm -53.0 -48.88 51.55 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 C-N-CA 123.508 0.723 . . . . 0.0 110.586 175.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -57.24 -60.99 2.79 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.949 0.404 . . . . 0.0 109.953 177.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -52.07 -40.63 61.48 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 125.418 1.487 . . . . 0.0 111.564 -174.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -46.36 -34.6 4.72 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.538 1.535 . . . . 0.0 111.623 179.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 85.4 m-85 -110.71 -50.15 2.98 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 122.817 0.447 . . . . 0.0 110.786 177.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 12.4 p -55.16 -38.05 67.78 Favored 'General case' 0 C--O 1.227 -0.104 0 C-N-CA 123.427 0.691 . . . . 0.0 111.126 -174.56 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -47.96 -30.5 7.24 Favored Glycine 0 CA--C 1.53 0.995 0 C-N-CA 124.431 1.015 . . . . 0.0 113.413 177.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 8.6 mtmp? -78.73 -27.76 44.9 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 118.045 0.923 . . . . 0.0 112.137 -178.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 49.9 mm-40 -73.58 146.65 44.56 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -176.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -48.55 -56.09 10.05 Favored Glycine 0 CA--C 1.529 0.936 0 C-N-CA 123.479 0.561 . . . . 0.0 112.057 -173.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 52.2 t0 -85.14 84.27 7.75 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 172.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 25.2 mmtm -40.0 -40.54 1.06 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.212 1.805 . . . . 0.0 114.295 -169.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 17.7 p-80 -80.98 12.13 3.54 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -176.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 32.6 p -132.49 164.41 26.64 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 123.947 0.899 . . . . 0.0 109.739 176.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -160.21 167.21 28.12 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.771 0.428 . . . . 0.0 110.936 169.736 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 46.7 m -113.71 170.09 8.5 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.923 1.289 . . . . 0.0 113.449 -169.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -32.2 -52.23 0.27 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 128.299 2.64 . . . . 0.0 115.265 178.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -59.03 -59.29 5.7 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -178.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -52.48 -39.88 61.69 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 123.521 0.728 . . . . 0.0 111.37 177.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 54.3 mt -65.05 -51.31 62.25 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 118.8 0.727 . . . . 0.0 112.079 179.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 8.2 mtmp? -61.77 -45.3 94.48 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 121.662 -0.649 . . . . 0.0 109.908 178.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -49.93 -56.91 8.74 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.45 0.7 . . . . 0.0 110.512 169.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 4.1 mt -45.5 -61.79 1.54 Allowed 'General case' 0 CA--C 1.521 -0.173 0 C-N-CA 124.351 1.06 . . . . 0.0 110.416 177.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 2.8 tp -60.55 -49.25 85.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 -173.376 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 -55.17 -48.55 73.62 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.302 1.041 . . . . 0.0 111.838 -178.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 8.5 mtmp? -76.66 -53.11 8.45 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 120.914 0.388 . . . . 0.0 111.264 -176.311 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -78.89 -26.47 43.86 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -167.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 49.9 mt -102.63 94.27 5.55 Favored 'General case' 0 N--CA 1.456 -0.132 0 N-CA-C 106.438 -1.69 . . . . 0.0 106.438 167.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 70.9 p -77.98 57.72 1.81 Allowed 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.62 0.768 . . . . 0.0 109.043 -177.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 45.6 mt -85.0 -60.2 2.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 C-N-CA 124.55 1.14 . . . . 0.0 107.925 -175.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 69.75 -70.38 0.56 Allowed Glycine 0 CA--C 1.529 0.906 0 N-CA-C 110.327 -1.109 . . . . 0.0 110.327 -176.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 20.1 m -66.05 79.32 0.09 Allowed 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 125.443 1.497 . . . . 0.0 109.59 171.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 39.6 mmtm -42.4 93.15 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.709 2.004 . . . . 0.0 112.127 -178.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 89.5 mt -44.96 -53.89 7.16 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 125.655 1.582 . . . . 0.0 113.017 -171.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -161.91 158.49 25.4 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 107.215 -1.402 . . . . 0.0 107.215 -172.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -32.69 -44.16 0.1 Allowed 'General case' 0 C--O 1.225 -0.235 0 C-N-CA 128.62 2.768 . . . . 0.0 114.203 -173.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.84 -59.69 0.17 Allowed 'General case' 0 CA--C 1.527 0.096 0 C-N-CA 125.882 1.673 . . . . 0.0 113.732 178.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 74.1 tt0 -65.86 -38.44 88.83 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.742 0.306 . . . . 0.0 110.695 -173.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.1 mp -63.5 -53.43 45.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 N-CA-C 106.893 -1.521 . . . . 0.0 106.893 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 78.8 t -56.02 -44.36 78.19 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 C-N-CA 124.226 1.011 . . . . 0.0 110.04 179.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -56.1 -53.91 51.38 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 118.779 0.718 . . . . 0.0 110.759 173.117 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 66.6 mt -53.56 -41.29 66.33 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 119.082 -0.485 . . . . 0.0 111.374 178.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 25.9 mmt -67.57 -61.36 1.93 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.896 0.771 . . . . 0.0 109.646 176.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -42.8 -43.88 4.19 Favored 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 127.441 2.296 . . . . 0.0 111.437 -177.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -39.64 -48.66 2.14 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.397 1.079 . . . . 0.0 112.302 176.115 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 10.2 mp -63.02 -48.59 78.11 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 -176.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -62.83 -45.32 93.17 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 122.825 0.45 . . . . 0.0 110.606 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 45.4 ttm-85 -55.73 -51.95 65.59 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 123.6 0.76 . . . . 0.0 109.198 176.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -84.32 59.74 5.57 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.079 0.552 . . . . 0.0 110.586 -176.675 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 4.5 mtmp? -71.83 73.68 0.84 Allowed 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 169.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 44.3 m-20 50.69 50.71 18.4 Favored 'General case' 0 CA--C 1.527 0.085 0 C-N-CA 125.497 1.519 . . . . 0.0 110.953 179.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -150.03 144.12 25.59 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 177.473 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -80.5 132.87 35.75 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 174.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 5.6 m -78.98 140.93 16.1 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 174.67 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 18.6 p30 -82.89 172.82 12.41 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 123.556 0.742 . . . . 0.0 110.902 175.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -44.34 -60.18 2.05 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.001 0.92 . . . . 0.0 112.56 176.049 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 50.4 tp60 -62.72 -35.51 79.98 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 119.381 0.991 . . . . 0.0 110.925 -175.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 57.9 mm-40 -60.82 -47.75 84.91 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 119.032 0.833 . . . . 0.0 111.094 173.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -53.25 -49.22 67.32 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 122.004 -0.435 . . . . 0.0 110.145 172.549 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.449 ' CG2' ' CG2' ' A' ' 74' ' ' ILE . 29.8 mm -57.83 -39.21 69.94 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 O-C-N 121.735 -0.603 . . . . 0.0 110.66 176.239 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 57.8 m -63.87 -41.09 97.83 Favored 'General case' 0 C--O 1.227 -0.125 0 O-C-N 121.587 -0.695 . . . . 0.0 110.106 177.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 32.0 t80 -54.32 -53.16 57.64 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 173.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 75.9 mt -62.4 -42.28 99.31 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 178.53 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.32 -42.39 94.07 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 110.718 -0.953 . . . . 0.0 110.718 -177.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.6 -46.76 88.45 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 123.41 0.684 . . . . 0.0 109.886 174.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 10.2 tp -51.51 -54.59 25.63 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 174.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -53.08 -52.5 58.38 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.899 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 28.8 mtt -50.7 -55.69 15.4 Favored 'General case' 0 CA--C 1.526 0.049 0 C-N-CA 123.825 0.85 . . . . 0.0 111.347 174.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 49.0 mt -63.12 -47.37 92.8 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.327 0 CA-C-O 118.105 -0.95 . . . . 0.0 110.433 -169.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.475 0.0 OUTLIER -83.48 -39.69 20.18 Favored 'General case' 0 C--N 1.347 0.463 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 179.818 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 16.4 m-80 -82.37 65.98 7.75 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 107.294 -1.373 . . . . 0.0 107.294 169.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -43.96 -37.86 3.15 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.543 1.137 . . . . 0.0 112.701 -174.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.27 -48.46 0.23 Allowed 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 127.024 2.13 . . . . 0.0 113.346 169.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 97.3 mt -63.67 -33.32 75.38 Favored 'General case' 0 CA--C 1.528 0.104 0 N-CA-C 112.573 0.583 . . . . 0.0 112.573 -176.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 29.7 mtmm -81.93 -43.18 18.44 Favored 'General case' 0 N--CA 1.455 -0.206 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 174.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.175 0 CA-C-O 117.17 -1.905 . . . . 0.0 110.712 -175.019 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.734 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -78.86 68.62 4.86 Favored 'General case' 0 C--O 1.234 0.259 0 O-C-N 122.089 -0.382 . . . . 0.0 111.317 -175.118 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.4 m -52.67 157.91 2.39 Favored Pre-proline 0 CA--C 1.534 0.353 0 C-N-CA 123.991 0.916 . . . . 0.0 110.266 172.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_exo -40.09 -52.03 2.98 Favored 'Trans proline' 0 N--CA 1.459 -0.511 0 C-N-CA 124.038 3.158 . . . . 0.0 113.82 -179.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.6 mt -54.05 -60.41 3.36 Favored 'General case' 0 C--O 1.225 -0.207 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 173.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -55.77 -40.11 72.14 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-O 121.004 0.43 . . . . 0.0 110.708 -175.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -64.96 -51.63 60.72 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.356 1.062 . . . . 0.0 110.144 -179.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.05 -46.77 87.4 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.221 1.008 . . . . 0.0 110.901 178.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 69.1 mt -51.94 -55.07 10.83 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 170.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.23 -47.88 20.95 Favored Glycine 0 CA--C 1.527 0.834 0 C-N-CA 125.148 1.356 . . . . 0.0 112.033 176.372 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.9 mt -55.0 -53.43 55.85 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.612 0.765 . . . . 0.0 110.986 174.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -59.33 -45.0 92.54 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 121.582 -0.699 . . . . 0.0 111.792 179.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 83.9 mt -55.72 -55.6 16.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 C-N-CA 123.714 0.806 . . . . 0.0 109.819 175.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -52.74 -51.97 41.32 Favored Glycine 0 CA--C 1.521 0.447 0 N-CA-C 109.724 -1.35 . . . . 0.0 109.724 -177.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 3.2 mm -56.71 -47.31 82.7 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 CA-C-O 119.332 -0.366 . . . . 0.0 110.634 179.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -53.03 -60.44 3.29 Favored 'General case' 0 C--N 1.339 0.14 0 CA-C-N 118.126 0.421 . . . . 0.0 110.055 175.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -60.55 -34.69 74.52 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 118.987 -0.53 . . . . 0.0 111.19 -171.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.3 ttpp -52.72 -37.9 59.92 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.134 0.574 . . . . 0.0 111.442 -179.258 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -97.27 -58.48 2.0 Favored 'General case' 0 C--O 1.227 -0.116 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 175.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.8 t -50.05 -35.7 26.12 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.369 1.068 . . . . 0.0 111.733 -173.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -39.83 -39.05 1.27 Allowed Glycine 0 CA--C 1.53 0.982 0 C-N-CA 125.362 1.458 . . . . 0.0 114.336 172.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 41.8 pttt -76.72 -18.78 58.3 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.271 1.035 . . . . 0.0 112.818 -174.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 60.1 mm-40 -76.25 148.61 37.49 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 179.292 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -55.21 -64.09 4.68 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 110.624 -0.99 . . . . 0.0 110.624 -178.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -79.34 75.47 5.92 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 107.094 -1.447 . . . . 0.0 107.094 169.507 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -54.34 -13.72 0.98 Allowed 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 115.022 1.489 . . . . 0.0 115.022 -172.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 9.9 m80 -77.81 -6.04 52.82 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.333 1.053 . . . . 0.0 110.708 176.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 31.6 p -134.5 161.8 34.04 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 125.987 1.715 . . . . 0.0 109.64 -179.498 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -158.43 177.55 11.13 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.816 1.247 . . . . 0.0 108.059 174.028 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 8.5 t -139.13 -169.46 2.66 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 119.861 1.209 . . . . 0.0 112.282 -175.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 41.9 pttt -41.44 -54.07 3.2 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 127.279 2.231 . . . . 0.0 113.61 -169.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -53.62 -51.94 61.47 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.064 0.546 . . . . 0.0 110.267 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 14.6 mp0 -64.92 -41.87 95.19 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 -178.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 41.8 mt -62.07 -47.38 84.91 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 118.544 0.611 . . . . 0.0 111.528 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -61.51 -49.94 74.72 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 176.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 78.3 tt0 -48.82 -54.89 13.32 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.168 0.987 . . . . 0.0 110.574 175.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.5 mt -48.41 -75.26 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 126.007 1.723 . . . . 0.0 109.022 174.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 15.6 tt -55.26 -47.05 78.16 Favored 'Isoleucine or valine' 0 C--N 1.341 0.235 0 CA-C-N 118.427 0.558 . . . . 0.0 111.268 -169.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.3 tt0 -52.23 -47.79 65.5 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 123.64 0.776 . . . . 0.0 111.37 -177.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 73.1 mttt -81.01 -62.58 1.62 Allowed 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 121.733 0.778 . . . . 0.0 109.506 -179.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -55.87 -36.33 67.47 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 114.842 -1.072 . . . . 0.0 111.882 -169.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 85.1 mt -119.28 62.25 0.8 Allowed 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 124.842 1.257 . . . . 0.0 107.743 171.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.4 t -69.23 53.47 0.1 Allowed 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.063 0.945 . . . . 0.0 110.848 169.229 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 62.8 mt -74.4 80.72 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -49.83 -36.19 25.82 Favored Glycine 0 CA--C 1.53 0.977 0 C-N-CA 124.247 0.927 . . . . 0.0 111.842 176.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.7 m -61.45 -17.5 54.67 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.732 1.213 . . . . 0.0 113.946 176.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt 49.31 60.65 3.62 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 125.442 1.497 . . . . 0.0 111.007 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 56.8 mt -66.81 77.48 0.12 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.615 1.166 . . . . 0.0 111.687 -178.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? 83.09 151.01 0.09 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 126.961 2.104 . . . . 0.0 111.464 172.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -42.08 -39.55 2.0 Allowed 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 127.822 2.449 . . . . 0.0 114.412 -169.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.84 -60.39 0.16 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.804 1.642 . . . . 0.0 114.1 -174.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -65.29 -42.68 92.89 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 122.958 0.503 . . . . 0.0 111.137 -175.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 1.2 mp -60.01 -53.01 54.5 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 N-CA-C 106.876 -1.528 . . . . 0.0 106.876 -178.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 72.1 t -54.13 -55.35 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 CA-C-N 115.523 -0.762 . . . . 0.0 108.976 178.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -47.26 -54.48 10.78 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 118.489 0.586 . . . . 0.0 111.724 178.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 25.8 mt -51.55 -41.11 60.87 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 -177.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -80.79 -65.26 1.03 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.343 0.657 . . . . 0.0 110.37 178.698 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -37.91 -42.43 0.62 Allowed 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 127.38 2.272 . . . . 0.0 112.139 179.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -38.22 -49.27 1.36 Allowed 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 124.671 1.188 . . . . 0.0 112.546 175.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.8 pp -58.73 -41.68 87.02 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.459 0.572 . . . . 0.0 111.148 -175.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -75.66 -46.28 32.3 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 123.661 0.784 . . . . 0.0 109.967 -178.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 59.7 ttm-85 -50.28 -47.78 55.21 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.831 0.852 . . . . 0.0 110.291 176.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -75.91 -60.06 2.49 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 22.3 ttpp 48.11 48.37 18.44 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.695 0.76 . . . . 0.0 109.4 -170.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 69.41 -2.6 1.83 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.227 1.811 . . . . 0.0 114.405 -179.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -70.22 145.37 51.45 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.633 1.106 . . . . 0.0 108.895 173.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -85.92 119.79 26.62 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 172.039 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.6 m -79.65 145.63 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 172.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.9 p-10 -88.54 177.88 6.67 Favored 'General case' 0 C--O 1.231 0.086 0 C-N-CA 122.832 0.453 . . . . 0.0 110.825 175.192 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -42.6 -59.73 1.8 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.684 0.794 . . . . 0.0 112.241 172.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 61.6 tp60 -60.75 -37.0 80.34 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 119.294 0.952 . . . . 0.0 111.683 -175.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -67.97 -37.43 81.52 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.248 -0.908 . . . . 0.0 111.217 176.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -58.0 -48.43 80.04 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.12 -0.988 . . . . 0.0 109.474 169.344 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 30.6 mm -58.76 -32.8 47.53 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 123.171 0.589 . . . . 0.0 110.497 175.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 56.0 m -69.86 -38.96 76.6 Favored 'General case' 0 C--O 1.225 -0.216 0 O-C-N 121.504 -0.747 . . . . 0.0 110.621 174.052 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -59.16 -55.73 31.28 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.56 0.618 . . . . 0.0 109.366 174.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 32.1 mt -56.8 -46.61 81.46 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 120.711 0.291 . . . . 0.0 110.931 175.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -58.18 -44.3 94.93 Favored Glycine 0 CA--C 1.525 0.673 0 C-N-CA 124.346 0.974 . . . . 0.0 111.448 -178.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.58 -47.43 69.75 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.45 0.7 . . . . 0.0 109.899 178.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -49.98 -54.3 20.86 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.446 0.641 . . . . 0.0 109.565 173.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -53.15 -55.57 23.07 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 124.702 1.201 . . . . 0.0 110.968 177.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 40.2 ttm -52.33 -52.12 54.96 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 124.775 1.23 . . . . 0.0 110.524 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 56.6 mt -62.81 -51.68 68.95 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-O 118.088 -0.958 . . . . 0.0 109.706 -172.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.427 0.0 OUTLIER -81.51 -32.31 32.42 Favored 'General case' 0 C--N 1.346 0.436 0 N-CA-C 114.667 1.358 . . . . 0.0 114.667 -176.392 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -80.36 76.48 7.17 Favored 'General case' 0 CA--C 1.521 -0.157 0 O-C-N 120.714 -1.242 . . . . 0.0 108.615 175.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -35.07 -49.83 0.48 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.522 1.529 . . . . 0.0 111.689 177.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -38.33 -43.78 0.84 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 126.893 2.077 . . . . 0.0 114.088 177.007 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 55.2 mt -61.96 -38.17 87.49 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 119.432 -0.318 . . . . 0.0 111.339 -178.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 9.8 mtmp? -79.87 55.06 1.99 Allowed 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.31 0.644 . . . . 0.0 111.635 -169.386 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.246 0 CA-C-O 116.731 -2.149 . . . . 0.0 110.107 176.245 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 28.0 ttt . . . . . 0 N--CA 1.474 0.758 0 CA-C-O 121.193 0.521 . . . . 0.0 110.045 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -73.02 78.6 1.19 Allowed 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 121.137 0.494 . . . . 0.0 110.581 -179.179 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 4.5 t -45.71 150.43 0.95 Allowed Pre-proline 0 CA--C 1.535 0.393 0 C-N-CA 124.292 1.037 . . . . 0.0 110.521 169.316 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo -43.56 -42.73 11.19 Favored 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 123.083 2.522 . . . . 0.0 112.097 168.596 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.0 mt -66.57 -43.06 86.0 Favored 'General case' 0 C--O 1.223 -0.331 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 174.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -57.07 -46.47 82.48 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 119.015 0.825 . . . . 0.0 109.407 177.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 -58.99 -52.73 64.49 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.57 0.748 . . . . 0.0 110.805 175.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.14 -46.76 85.73 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.301 0.64 . . . . 0.0 112.063 -175.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 73.9 mt -54.5 -53.21 32.95 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 N-CA-C 107.886 -1.154 . . . . 0.0 107.886 170.603 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.25 -46.27 15.99 Favored Glycine 0 CA--C 1.528 0.846 0 C-N-CA 124.64 1.114 . . . . 0.0 112.067 175.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 mt -58.23 -57.37 13.18 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.918 0.887 . . . . 0.0 110.918 174.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.07 -43.74 87.14 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.264 0.938 . . . . 0.0 111.669 -178.405 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 59.3 mt -56.35 -55.35 19.44 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.156 0 C-N-CA 123.623 0.769 . . . . 0.0 110.0 173.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.89 -49.15 63.28 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 110.566 -1.014 . . . . 0.0 110.566 -177.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 11.2 mm -53.06 -49.37 50.28 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 C-N-CA 123.454 0.701 . . . . 0.0 109.871 175.05 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 37.7 t80 -56.8 -52.43 65.07 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 121.805 -0.559 . . . . 0.0 110.768 176.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -58.57 -38.3 77.58 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 124.687 1.195 . . . . 0.0 111.106 -174.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 61.8 tttm -57.76 -25.82 60.99 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.933 1.293 . . . . 0.0 112.497 -179.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 56.2 m-85 -117.1 -62.22 1.61 Allowed 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.372 0.669 . . . . 0.0 109.903 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -64.86 -48.93 72.53 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 124.164 0.985 . . . . 0.0 110.162 -176.6 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.89 56.6 3.9 Favored Glycine 0 C--N 1.339 0.712 0 C-N-CA 124.257 0.932 . . . . 0.0 111.969 -172.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 36.5 mtmt -146.47 -44.94 0.19 Allowed 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 127.556 2.343 . . . . 0.0 106.806 176.063 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 63.8 mt-10 -60.68 147.84 40.67 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 168.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -52.64 -43.44 59.48 Favored Glycine 0 CA--C 1.53 1.014 0 N-CA-C 111.517 -0.633 . . . . 0.0 111.517 -178.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -78.96 59.66 2.7 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.459 1.104 . . . . 0.0 110.134 177.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -50.51 -27.6 6.91 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.102 1.361 . . . . 0.0 113.791 -173.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 12.9 t-80 -76.92 -5.06 47.01 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.158 0.583 . . . . 0.0 111.976 -175.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -138.54 158.75 43.66 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 125.195 1.398 . . . . 0.0 111.316 -169.052 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.47 176.11 12.0 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 125.388 1.475 . . . . 0.0 108.212 171.397 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 7.3 t -135.59 -166.27 1.82 Allowed 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.731 1.151 . . . . 0.0 113.304 177.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -38.67 -65.12 0.38 Allowed 'General case' 0 N--CA 1.458 -0.064 0 C-N-CA 128.19 2.596 . . . . 0.0 113.175 -169.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 36.3 ttpt -51.96 -50.3 61.49 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 123.465 0.706 . . . . 0.0 110.238 -175.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -61.36 -43.97 97.97 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 123.25 0.62 . . . . 0.0 110.15 -177.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 34.7 mt -62.4 -50.89 69.73 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 118.187 0.449 . . . . 0.0 111.546 177.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -61.93 -42.3 98.94 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 -178.211 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -56.42 -65.33 0.62 Allowed 'General case' 0 C--O 1.22 -0.476 0 CA-C-O 118.515 -0.755 . . . . 0.0 109.13 169.51 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 5.5 mt -35.04 -62.98 0.35 Allowed 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 125.321 1.449 . . . . 0.0 111.687 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 15.9 tt -60.49 -50.78 79.0 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 C-N-CA 120.297 -0.561 . . . . 0.0 110.306 -175.074 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 16.0 tt0 -62.11 -41.07 97.86 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.317 0.508 . . . . 0.0 112.151 -176.301 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 6.2 mmpt? -69.85 -54.13 14.92 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.637 1.175 . . . . 0.0 109.473 -177.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 -83.43 -35.54 24.92 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.58 -0.736 . . . . 0.0 112.682 -167.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 47.1 mt -85.03 87.32 7.36 Favored 'General case' 0 C--N 1.339 0.14 0 CA-C-N 119.36 0.982 . . . . 0.0 108.809 170.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 64.2 p -78.62 55.61 1.68 Allowed 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 177.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 55.3 mt -86.0 -59.0 3.0 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 C-N-CA 124.742 1.217 . . . . 0.0 108.763 -173.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.31 -65.68 1.29 Allowed Glycine 0 CA--C 1.53 0.981 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 -176.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 49.2 m -69.92 74.17 0.44 Allowed 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 124.145 0.978 . . . . 0.0 109.319 170.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 26.8 mtmm -47.7 96.31 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.983 1.713 . . . . 0.0 111.474 -178.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 72.5 mt -40.28 -46.7 2.35 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 126.806 2.043 . . . . 0.0 113.674 -173.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -157.95 170.0 23.3 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 -178.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -36.41 -42.45 0.33 Allowed 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 126.868 2.067 . . . . 0.0 113.095 173.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.35 -58.15 0.15 Allowed 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 126.541 1.936 . . . . 0.0 113.972 -178.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 65.0 tt0 -68.34 -40.41 81.57 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 121.066 0.46 . . . . 0.0 110.878 -172.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.9 mp -62.99 -52.5 58.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 N-CA-C 106.865 -1.531 . . . . 0.0 106.865 179.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 72.0 t -54.85 -46.63 75.49 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 C-N-CA 124.362 1.065 . . . . 0.0 109.829 178.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.42 -53.61 54.07 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 119.402 1.001 . . . . 0.0 110.565 175.404 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 39.9 mt -53.22 -41.47 65.38 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 118.972 -0.537 . . . . 0.0 111.494 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 27.8 mmt -70.21 -65.14 0.76 Allowed 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 118.716 0.689 . . . . 0.0 109.643 175.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -43.71 -35.02 1.67 Allowed 'General case' 0 CA--C 1.518 -0.282 0 C-N-CA 128.356 2.662 . . . . 0.0 112.192 -174.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -37.85 -49.97 1.24 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.0 0.92 . . . . 0.0 111.87 173.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.9 pp -61.34 -43.48 98.79 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.366 0.53 . . . . 0.0 111.331 -177.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -69.6 -41.11 76.19 Favored 'General case' 0 C--O 1.226 -0.183 0 C-N-CA 123.941 0.896 . . . . 0.0 110.113 -177.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 14.2 ttm180 -62.73 -48.5 78.96 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 124.76 1.224 . . . . 0.0 110.033 179.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -77.64 -41.59 37.83 Favored 'General case' 0 C--O 1.226 -0.143 0 CA-C-N 116.713 -0.221 . . . . 0.0 111.248 -175.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 84.7 mttt 55.72 24.85 7.62 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.197 0.999 . . . . 0.0 111.735 -169.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 64.32 36.47 9.14 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.967 1.707 . . . . 0.0 112.221 -172.103 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -122.91 163.94 19.41 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 106.161 -1.792 . . . . 0.0 106.161 166.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 16.3 mp0 -75.51 144.68 41.86 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 123.171 0.589 . . . . 0.0 110.839 178.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 25.2 m -101.56 151.22 5.65 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 N-CA-C 106.698 -1.593 . . . . 0.0 106.698 167.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 10.2 p30 -94.67 171.86 8.53 Favored 'General case' 0 C--O 1.231 0.129 0 C-N-CA 123.404 0.682 . . . . 0.0 110.624 176.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -35.5 -59.87 0.53 Allowed 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.351 1.461 . . . . 0.0 113.486 177.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -66.53 -31.77 72.71 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 120.429 1.468 . . . . 0.0 111.616 -174.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.34 -36.44 68.81 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 121.271 -0.893 . . . . 0.0 109.822 177.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -56.29 -53.77 53.29 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 168.4 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 19.9 mm -53.74 -42.0 49.96 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.406 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 177.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 70.4 m -63.06 -27.21 69.24 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 119.018 0.827 . . . . 0.0 111.831 177.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 10.7 t80 -58.35 -52.84 63.92 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.459 1.027 . . . . 0.0 108.321 170.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 48.8 mt -64.61 -41.31 96.29 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.861 0.865 . . . . 0.0 111.668 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -70.78 -42.27 61.77 Favored Glycine 0 CA--C 1.526 0.749 0 C-N-CA 124.408 1.004 . . . . 0.0 110.658 -175.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.21 -43.91 76.96 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 121.924 -0.75 . . . . 0.0 110.079 175.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 12.1 tp -49.61 -56.8 8.71 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 121.281 0.563 . . . . 0.0 109.774 171.159 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.15 -53.67 25.99 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 124.391 1.076 . . . . 0.0 110.32 178.188 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 53.7 ttm -54.45 -50.07 68.55 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.937 0.895 . . . . 0.0 111.129 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 98.1 mt -63.95 -55.01 24.63 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 CA-C-O 118.48 -0.772 . . . . 0.0 110.578 -176.154 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.45 0.1 OUTLIER -76.69 -35.2 58.04 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.419 1.009 . . . . 0.0 113.284 -175.029 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 26.0 m-80 -82.55 72.79 9.61 Favored 'General case' 0 N--CA 1.465 0.284 0 O-C-N 120.63 -1.294 . . . . 0.0 107.97 169.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -46.89 -31.48 3.14 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.968 0.907 . . . . 0.0 113.051 -176.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -42.15 -41.88 2.81 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.879 1.272 . . . . 0.0 113.106 172.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 84.2 mt -68.25 -24.4 64.89 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.161 0.584 . . . . 0.0 112.424 -179.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 9.8 mtmp? -83.28 -51.98 6.97 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 172.119 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.218 0 CA-C-O 117.0 -2.0 . . . . 0.0 112.502 178.864 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.0 mtm . . . . . 0 N--CA 1.474 0.727 0 CA-C-O 120.481 0.181 . . . . 0.0 110.776 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -78.4 67.14 4.12 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 120.868 0.366 . . . . 0.0 110.523 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.59 165.84 2.07 Favored Pre-proline 0 CA--C 1.538 0.493 0 C-N-CA 124.282 1.033 . . . . 0.0 111.143 176.922 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_exo -46.26 -47.98 13.99 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 123.367 2.711 . . . . 0.0 113.054 178.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.1 mt -56.95 -49.84 74.46 Favored 'General case' 0 C--N 1.34 0.168 0 CA-C-O 119.472 -0.299 . . . . 0.0 111.428 175.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -58.97 -45.04 91.52 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-N 118.248 0.476 . . . . 0.0 109.857 -178.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -59.43 -49.99 75.67 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 122.9 0.48 . . . . 0.0 110.239 178.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.69 -45.87 84.8 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.416 0.687 . . . . 0.0 111.666 -177.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 71.5 mt -54.72 -50.94 56.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 171.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.74 -49.44 22.09 Favored Glycine 0 CA--C 1.526 0.771 0 C-N-CA 125.012 1.291 . . . . 0.0 111.527 174.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.3 mt -54.79 -56.67 16.89 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 117.576 0.688 . . . . 0.0 110.889 173.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -57.28 -42.59 81.93 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 119.203 0.91 . . . . 0.0 111.72 -178.366 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 95.6 mt -59.81 -54.11 39.11 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 123.518 0.727 . . . . 0.0 110.908 174.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.4 -50.59 61.63 Favored Glycine 0 CA--C 1.522 0.511 0 N-CA-C 109.883 -1.287 . . . . 0.0 109.883 -177.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 9.9 mm -50.87 -51.76 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 C-N-CA 123.92 0.888 . . . . 0.0 109.968 173.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -52.24 -61.57 2.19 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 178.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 6.0 m-70 -65.33 -23.87 67.11 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 113.958 1.096 . . . . 0.0 113.958 -172.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 62.4 tttm -50.24 -31.94 15.35 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 118.766 0.712 . . . . 0.0 111.147 169.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -113.0 -33.54 6.01 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.482 0.713 . . . . 0.0 112.683 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 77.4 p -89.12 -32.08 17.68 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 119.891 1.223 . . . . 0.0 113.204 -178.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -79.96 50.82 3.98 Favored Glycine 0 C--N 1.334 0.471 0 C-N-CA 124.004 0.812 . . . . 0.0 112.232 -168.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 5.1 mmmm -115.99 -48.21 2.75 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 123.424 0.69 . . . . 0.0 111.795 -168.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -161.34 167.21 26.24 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 179.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 49.12 -124.48 13.33 Favored Glycine 0 CA--C 1.528 0.887 0 C-N-CA 124.775 1.179 . . . . 0.0 112.818 172.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -78.9 71.47 5.36 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.195 0.598 . . . . 0.0 109.39 -174.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 65.0 mttm -56.43 -15.86 4.84 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.18 0.992 . . . . 0.0 113.063 -179.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 9.7 t-80 -77.18 -4.33 44.06 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.627 0.771 . . . . 0.0 111.798 175.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 46.0 p -130.22 166.57 20.02 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 125.014 1.325 . . . . 0.0 111.452 -179.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -161.16 -177.19 5.9 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.377 1.471 . . . . 0.0 107.616 168.57 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.4 p -139.25 176.84 8.37 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 119.59 1.086 . . . . 0.0 112.805 -173.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 19.8 pttt -30.84 -53.78 0.19 Allowed 'General case' 0 N--CA 1.457 -0.099 0 C-N-CA 127.646 2.378 . . . . 0.0 114.874 179.057 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 24.8 ttpp -58.07 -49.12 78.03 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 118.888 0.767 . . . . 0.0 110.743 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.4 mp0 -64.07 -36.02 82.63 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 122.685 0.394 . . . . 0.0 110.619 178.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 45.2 mt -68.07 -47.6 67.85 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.617 0.644 . . . . 0.0 111.204 179.117 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -56.44 -47.38 79.22 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 173.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -53.81 -58.08 8.54 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-O 119.167 -0.445 . . . . 0.0 110.975 172.77 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.0 mt -45.52 -61.18 1.79 Allowed 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 124.291 1.036 . . . . 0.0 110.406 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 14.7 tt -61.06 -50.27 81.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 C-N-CA 120.507 -0.477 . . . . 0.0 109.858 -175.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -61.85 -53.18 59.39 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 121.493 -0.754 . . . . 0.0 112.305 -175.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -67.02 -59.03 3.82 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.988 0.915 . . . . 0.0 109.39 -178.315 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -79.78 -46.67 16.56 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 119.262 -0.399 . . . . 0.0 111.742 -168.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 20.1 mt -84.18 61.36 6.47 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 119.001 0.819 . . . . 0.0 109.41 174.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.3 t -73.58 69.25 1.24 Allowed 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 105.919 -1.882 . . . . 0.0 105.919 167.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 13.1 tt -78.73 -33.6 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 C-N-CA 125.359 1.464 . . . . 0.0 111.635 -168.342 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 134.51 -154.99 21.69 Favored Glycine 0 CA--C 1.522 0.496 0 N-CA-C 106.935 -2.466 . . . . 0.0 106.935 -170.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.5 p -75.95 67.53 2.33 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 117.725 0.762 . . . . 0.0 110.504 -179.264 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 34.0 mtmm 49.06 67.01 0.94 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.042 1.337 . . . . 0.0 111.29 173.671 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 11.7 mt -67.58 85.54 0.19 Allowed 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -169.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? 89.23 145.12 0.04 OUTLIER 'General case' 0 C--O 1.235 0.315 0 C-N-CA 127.936 2.494 . . . . 0.0 111.249 171.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -36.61 -43.98 0.43 Allowed 'General case' 0 C--O 1.225 -0.235 0 C-N-CA 128.002 2.521 . . . . 0.0 113.387 -169.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -30.33 -56.47 0.19 Allowed 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 125.793 1.637 . . . . 0.0 113.382 176.346 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.9 tm-20 -64.89 -41.52 95.55 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.64 0.734 . . . . 0.0 110.384 -173.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 1.1 mp -66.28 -52.74 44.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 N-CA-C 107.053 -1.462 . . . . 0.0 107.053 -177.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 78.6 t -52.89 -41.06 38.72 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 C-N-CA 124.64 1.176 . . . . 0.0 109.777 175.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.7 mptp? -60.53 -51.88 67.54 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 118.988 0.813 . . . . 0.0 110.851 174.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 85.6 mt -52.08 -43.0 63.65 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 119.316 -0.373 . . . . 0.0 110.872 177.036 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 24.7 mmt -68.75 -62.42 1.39 Allowed 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 118.475 0.579 . . . . 0.0 109.94 178.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -45.26 -40.61 7.71 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 127.093 2.157 . . . . 0.0 111.498 -177.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -40.94 -47.31 2.98 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.714 0.806 . . . . 0.0 112.462 175.029 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.1 mp -63.39 -53.86 45.87 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 -178.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -60.95 -34.11 74.23 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 123.625 0.77 . . . . 0.0 111.279 -178.06 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.9 ttm180 -65.51 -55.68 16.52 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 173.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -85.16 67.26 10.11 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 123.397 0.679 . . . . 0.0 109.915 -175.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 49.3 mttp -73.0 65.99 0.78 Allowed 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 171.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 49.97 48.01 22.48 Favored 'General case' 0 CA--C 1.528 0.125 0 C-N-CA 125.321 1.448 . . . . 0.0 110.96 -173.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 26.3 mm-40 -138.76 152.03 47.6 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 125.59 1.556 . . . . 0.0 106.924 172.675 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -82.28 152.7 26.22 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.38 0.672 . . . . 0.0 109.593 171.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 11.3 m -103.07 144.31 14.01 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 170.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -86.29 168.4 13.93 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 122.835 0.454 . . . . 0.0 111.158 174.25 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -34.4 -61.31 0.39 Allowed 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 124.547 1.139 . . . . 0.0 112.718 172.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 48.5 tp60 -63.22 -31.66 72.86 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 119.791 1.178 . . . . 0.0 112.072 -174.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -69.68 -42.43 74.14 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 121.305 -0.872 . . . . 0.0 110.022 176.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -54.92 -51.38 66.26 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 170.769 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 26.9 mm -56.25 -40.26 64.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 C-N-CA 123.158 0.583 . . . . 0.0 110.117 176.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 86.2 m -64.6 -39.01 92.96 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 118.926 0.784 . . . . 0.0 110.961 176.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 44.9 t80 -54.95 -53.54 54.29 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 172.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 58.7 mt -59.14 -42.18 90.03 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.962 -0.461 . . . . 0.0 111.83 176.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -62.41 -45.86 95.05 Favored Glycine 0 CA--C 1.525 0.709 0 C-N-CA 124.177 0.894 . . . . 0.0 110.959 -178.436 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.89 -44.68 84.6 Favored 'General case' 0 N--CA 1.45 -0.458 0 O-C-N 122.182 -0.599 . . . . 0.0 110.061 177.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 13.1 tp -51.18 -57.24 9.28 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.325 0.583 . . . . 0.0 109.899 173.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -48.75 -56.17 9.38 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 114.812 -1.085 . . . . 0.0 109.942 177.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 46.7 ttm -52.33 -54.44 31.55 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 123.916 0.886 . . . . 0.0 111.071 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 42.1 mt -63.49 -45.75 96.98 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 CA-C-O 118.302 -0.856 . . . . 0.0 110.856 -171.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.446 0.1 OUTLIER -83.05 -30.93 27.66 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 -179.844 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 24.3 m-80 -79.8 71.95 6.49 Favored 'General case' 0 C--O 1.236 0.355 0 O-C-N 120.926 -1.109 . . . . 0.0 108.433 170.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -65.0 74.18 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.572 1.549 . . . . 0.0 109.431 175.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -171.89 -47.38 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 128.684 2.794 . . . . 0.0 106.851 -169.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 55.7 mt -58.58 -43.28 89.4 Favored 'General case' 0 C--N 1.343 0.306 0 N-CA-C 108.412 -0.958 . . . . 0.0 108.412 168.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -67.49 71.37 0.12 Allowed 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 168.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.221 0 CA-C-O 117.642 -1.644 . . . . 0.0 110.267 -169.922 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 3.7 mpp? . . . . . 0 N--CA 1.472 0.659 0 N-CA-C 110.396 -0.224 . . . . 0.0 110.396 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -74.09 75.92 1.74 Allowed 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 175.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -49.42 157.31 0.94 Allowed Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 125.459 1.504 . . . . 0.0 110.35 173.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -50.67 -48.42 20.65 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 122.911 2.407 . . . . 0.0 112.213 -174.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.7 mt -55.26 -52.82 62.17 Favored 'General case' 0 C--O 1.225 -0.231 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 172.146 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -58.68 -39.67 81.36 Favored 'General case' 0 C--O 1.225 -0.186 0 CA-C-N 118.243 0.474 . . . . 0.0 110.274 -175.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -64.33 -50.99 65.62 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.503 1.121 . . . . 0.0 110.483 177.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.53 -45.44 94.15 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 121.443 0.639 . . . . 0.0 111.128 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 67.1 mt -53.19 -53.97 20.11 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 169.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.6 -46.96 18.08 Favored Glycine 0 CA--C 1.526 0.775 0 C-N-CA 125.368 1.461 . . . . 0.0 111.986 176.249 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.7 mt -55.45 -56.07 24.4 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 117.635 0.717 . . . . 0.0 110.742 173.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.4 mp -57.59 -42.94 84.21 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 118.973 0.806 . . . . 0.0 111.6 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 77.8 mt -56.97 -55.55 19.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 C-N-CA 123.336 0.654 . . . . 0.0 110.173 174.096 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.24 -49.68 62.69 Favored Glycine 0 CA--C 1.522 0.527 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 -177.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.5 mm -52.36 -48.71 44.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 C-N-CA 123.242 0.617 . . . . 0.0 110.137 174.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -56.51 -58.2 9.05 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 118.491 0.587 . . . . 0.0 110.47 176.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -54.61 -36.96 65.03 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 125.002 1.321 . . . . 0.0 111.208 -174.594 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -49.7 -34.43 18.7 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.062 0.945 . . . . 0.0 111.957 177.215 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 -106.62 -47.67 3.71 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.325 0.65 . . . . 0.0 110.837 178.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 22.7 t -63.64 -24.7 67.9 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.839 0.856 . . . . 0.0 112.422 -177.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -72.7 45.13 1.03 Allowed Glycine 0 CA--C 1.529 0.915 0 C-N-CA 124.267 0.936 . . . . 0.0 114.613 -172.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 25.0 mttm -142.18 -43.47 0.33 Allowed 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 118.554 1.177 . . . . 0.0 111.246 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -75.29 47.5 0.38 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.911 1.284 . . . . 0.0 114.369 -168.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 69.11 -74.68 0.36 Allowed Glycine 0 CA--C 1.529 0.922 0 C-N-CA 123.957 0.789 . . . . 0.0 112.155 174.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -89.92 105.45 17.81 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 172.138 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 30.0 mmtm -80.26 48.02 0.97 Allowed 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.568 0.747 . . . . 0.0 111.068 -171.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 45.6 t-80 -122.85 -10.47 8.24 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 125.691 1.597 . . . . 0.0 111.429 -174.167 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 41.3 p -135.04 163.05 30.75 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.899 1.28 . . . . 0.0 110.459 -175.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -159.87 164.95 33.14 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.527 0.731 . . . . 0.0 110.988 169.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 93.6 p -97.97 168.0 10.56 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.462 1.105 . . . . 0.0 113.641 -169.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 13.6 pttm -40.04 -53.19 2.43 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 126.781 2.032 . . . . 0.0 112.617 171.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -54.65 -45.45 73.82 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.39 0.676 . . . . 0.0 109.968 178.771 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -71.36 -35.79 71.24 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 123.485 0.714 . . . . 0.0 111.073 -176.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 13.3 mt -62.91 -49.35 75.13 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.224 0.92 . . . . 0.0 110.896 170.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -58.03 -46.31 85.52 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 178.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -54.08 -57.17 12.09 Favored 'General case' 0 C--O 1.222 -0.344 0 CA-C-O 119.001 -0.524 . . . . 0.0 110.663 171.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 9.3 mt -45.44 -60.73 2.0 Favored 'General case' 0 N--CA 1.457 -0.09 0 C-N-CA 123.625 0.77 . . . . 0.0 110.48 -178.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 19.8 tt -60.1 -52.98 54.87 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 120.287 -0.565 . . . . 0.0 110.118 -177.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -59.47 -49.88 76.07 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.739 -0.601 . . . . 0.0 112.535 -174.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.11 -53.79 10.14 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.696 0.798 . . . . 0.0 109.815 -176.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 51.8 mm-40 -81.68 -26.62 34.55 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 -167.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 23.9 mt -102.14 89.98 3.79 Favored 'General case' 0 CA--C 1.523 -0.083 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 169.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 63.0 p -76.44 61.43 1.72 Allowed 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 124.624 1.17 . . . . 0.0 108.783 179.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 15.2 mt -80.36 -60.29 2.34 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 177.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 69.2 -73.1 0.41 Allowed Glycine 0 CA--C 1.528 0.844 0 N-CA-C 110.425 -1.07 . . . . 0.0 110.425 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 15.6 m -61.31 99.93 0.12 Allowed 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 124.6 1.16 . . . . 0.0 108.467 169.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 25.0 mmtm -59.91 80.58 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.969 1.708 . . . . 0.0 111.93 -171.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . 0.258 4.3 pp -57.67 -35.67 70.87 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -169.014 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -164.05 153.51 14.18 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 119.254 0.933 . . . . 0.0 108.733 179.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -41.92 -40.05 2.03 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 128.137 2.575 . . . . 0.0 114.162 -171.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -35.7 -56.1 0.69 Allowed 'General case' 0 C--O 1.226 -0.14 0 C-N-CA 125.356 1.462 . . . . 0.0 113.148 -175.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -61.69 -41.83 98.11 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.444 0.697 . . . . 0.0 111.18 -176.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.1 mp -63.75 -54.08 36.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 106.852 -1.536 . . . . 0.0 106.852 -178.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 82.5 t -56.84 -41.13 75.22 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-N 115.265 -0.88 . . . . 0.0 109.729 179.157 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.44 -51.81 68.3 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 118.907 0.776 . . . . 0.0 110.073 177.507 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 44.9 mt -53.87 -41.11 67.16 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 119.361 -0.352 . . . . 0.0 111.404 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.05 -61.68 1.68 Allowed 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 118.642 0.656 . . . . 0.0 109.753 175.324 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -44.37 -36.4 2.82 Favored 'General case' 0 C--O 1.225 -0.205 0 C-N-CA 126.644 1.978 . . . . 0.0 111.949 -177.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -37.38 -46.88 0.81 Allowed 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 125.661 1.584 . . . . 0.0 112.717 178.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -59.27 -49.71 76.8 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 120.665 0.269 . . . . 0.0 110.394 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -64.42 -42.96 95.76 Favored 'General case' 0 C--O 1.225 -0.216 0 C-N-CA 124.089 0.956 . . . . 0.0 110.1 179.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.69 -45.33 70.33 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.697 1.599 . . . . 0.0 109.4 176.64 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -73.12 -44.27 60.52 Favored 'General case' 0 C--O 1.227 -0.091 0 C-N-CA 122.94 0.496 . . . . 0.0 112.136 178.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 86.0 mttt 58.33 33.2 22.92 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 -166.372 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 54.04 18.8 1.82 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 126.445 1.898 . . . . 0.0 114.53 -169.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 54.1 mm-40 -106.35 158.67 16.71 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 106.673 -1.602 . . . . 0.0 106.673 167.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -66.1 142.12 57.89 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.127 172.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 14.5 m -86.57 150.78 3.74 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 171.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 5.2 p30 -91.35 172.78 8.29 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 123.293 0.637 . . . . 0.0 111.86 176.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -41.42 -62.13 0.92 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.258 1.023 . . . . 0.0 113.591 177.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 10.0 tp-100 -65.4 -31.35 72.41 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-N 120.094 1.316 . . . . 0.0 110.808 -177.085 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -64.14 -41.3 97.24 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.175 0.898 . . . . 0.0 110.569 175.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -57.78 -49.76 75.52 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 121.462 -0.774 . . . . 0.0 110.023 169.658 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 21.5 mm -60.07 -26.7 36.96 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 O-C-N 121.787 -0.571 . . . . 0.0 110.782 176.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 52.8 m -75.05 -37.5 61.67 Favored 'General case' 0 C--O 1.225 -0.225 0 O-C-N 120.95 -1.094 . . . . 0.0 110.345 173.072 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 29.1 t80 -55.29 -55.06 35.79 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 118.914 0.779 . . . . 0.0 109.235 170.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 43.9 mt -61.22 -47.3 86.76 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 122.085 -0.385 . . . . 0.0 111.694 177.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -62.1 -41.89 99.71 Favored Glycine 0 CA--C 1.526 0.735 0 N-CA-C 110.946 -0.862 . . . . 0.0 110.946 -175.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.18 -46.5 73.74 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 123.498 0.719 . . . . 0.0 110.268 175.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 18.1 tp -49.97 -53.55 25.73 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 174.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -53.48 -56.83 13.68 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 124.065 0.946 . . . . 0.0 110.394 175.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 40.3 ttm -47.94 -46.62 32.36 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.79 0.836 . . . . 0.0 111.052 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 30.8 mt -72.89 -51.92 24.85 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 CA-C-O 117.908 -1.044 . . . . 0.0 111.379 -176.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.416 0.0 OUTLIER -85.11 -36.46 21.13 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 120.31 1.414 . . . . 0.0 114.711 -175.198 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 32.8 m120 -81.87 62.44 5.66 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 107.259 -1.385 . . . . 0.0 107.259 171.036 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 67.2 mt-10 -44.97 -36.49 3.42 Favored 'General case' 0 C--N 1.339 0.111 0 C-N-CA 126.104 1.762 . . . . 0.0 113.618 -169.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -47.77 -31.93 5.41 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.384 1.074 . . . . 0.0 113.015 178.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 31.6 mt -50.16 -39.89 45.01 Favored 'General case' 0 C--N 1.34 0.177 0 C-N-CA 122.761 0.424 . . . . 0.0 111.949 174.272 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 8.6 mtmp? -77.83 51.89 0.98 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.7 0.8 . . . . 0.0 111.959 -172.049 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.11 0 CA-C-O 117.57 -1.683 . . . . 0.0 110.34 177.768 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.7 ptm . . . . . 0 N--CA 1.476 0.852 0 CA-C-O 121.966 0.888 . . . . 0.0 110.584 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -72.18 82.72 1.0 Allowed 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.178 -173.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.4 m -49.25 158.59 0.72 Allowed Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 124.202 1.001 . . . . 0.0 111.433 170.025 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -47.54 -48.28 15.89 Favored 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 123.354 2.703 . . . . 0.0 113.402 -177.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.0 mt -57.42 -49.24 76.87 Favored 'General case' 0 C--O 1.226 -0.183 0 C-N-CA 120.618 -0.433 . . . . 0.0 112.094 173.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -60.97 -41.57 96.63 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 -175.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 19.8 tt0 -59.77 -51.63 68.93 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.801 0.84 . . . . 0.0 110.677 175.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.35 -45.67 92.15 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.506 0.669 . . . . 0.0 111.271 -177.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 66.1 mt -53.28 -51.75 37.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 169.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.17 -48.2 20.35 Favored Glycine 0 CA--C 1.528 0.86 0 C-N-CA 125.183 1.373 . . . . 0.0 111.835 174.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.3 mt -55.12 -55.25 33.18 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 117.83 0.815 . . . . 0.0 110.795 174.067 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.0 mp -58.2 -41.71 84.6 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.55 0.614 . . . . 0.0 111.715 -179.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 97.1 mt -60.58 -51.33 74.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 C-N-CA 123.494 0.718 . . . . 0.0 110.733 174.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.99 -54.03 36.37 Favored Glycine 0 CA--C 1.521 0.462 0 N-CA-C 109.198 -1.561 . . . . 0.0 109.198 -179.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 7.2 mm -51.51 -50.77 28.3 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 C-N-CA 124.102 0.961 . . . . 0.0 110.375 175.145 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -50.63 -60.51 2.96 Favored 'General case' 0 C--N 1.339 0.121 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 177.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -59.33 -39.39 82.97 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 121.041 -0.263 . . . . 0.0 111.088 -175.622 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.7 ttpp -53.64 -24.77 15.23 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.096 0.958 . . . . 0.0 111.85 178.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -133.9 42.2 2.95 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 118.461 0.573 . . . . 0.0 110.774 169.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 63.6 p -83.05 -87.62 0.1 Allowed 'General case' 0 N--CA 1.457 -0.114 0 CA-C-O 122.254 1.026 . . . . 0.0 108.487 174.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -163.18 71.36 0.2 Allowed Glycine 0 N--CA 1.442 -0.917 0 N-CA-C 106.303 -2.719 . . . . 0.0 106.303 175.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 46.7 mtmt -55.82 120.51 7.47 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 178.134 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 58.76 33.32 22.98 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.532 1.133 . . . . 0.0 112.614 -173.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -162.0 -103.84 0.18 Allowed Glycine 0 CA--C 1.528 0.875 0 N-CA-C 110.142 -1.183 . . . . 0.0 110.142 173.17 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -79.38 62.79 3.82 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.845 -0.797 . . . . 0.0 111.176 -176.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.5 mptm? -39.65 -43.72 1.4 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.254 1.422 . . . . 0.0 114.1 -171.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 26.1 m80 -120.15 20.38 12.06 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 -169.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 6.0 p -140.46 173.07 11.86 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 173.281 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.2 pp -160.25 -176.31 5.56 Favored 'General case' 0 C--N 1.337 0.024 0 C-N-CA 123.873 0.869 . . . . 0.0 109.533 176.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 87.4 p -152.7 -175.52 5.34 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 119.073 0.851 . . . . 0.0 111.955 -178.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -19.7 -69.56 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 129.381 3.072 . . . . 0.0 113.51 175.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -51.53 -50.63 59.64 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 124.874 1.269 . . . . 0.0 110.568 -177.394 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 14.1 mp0 -64.65 -42.77 95.21 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 119.157 -0.449 . . . . 0.0 109.87 -177.485 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 71.9 mt -60.99 -50.1 74.76 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.881 0.764 . . . . 0.0 111.21 177.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -59.56 -44.96 93.12 Favored 'General case' 0 CA--C 1.534 0.36 0 O-C-N 121.937 -0.477 . . . . 0.0 110.298 179.117 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 72.0 mt-10 -56.42 -52.36 64.93 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 122.57 0.348 . . . . 0.0 111.197 173.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 16.3 mt -49.51 -54.82 15.83 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.726 0.81 . . . . 0.0 109.471 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 40.7 mm -54.45 -65.87 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 175.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 -57.0 -49.24 76.39 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -169.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.7 -53.76 8.03 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.2 0.6 . . . . 0.0 110.426 -177.291 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -85.22 -16.59 39.73 Favored 'General case' 0 C--N 1.339 0.14 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -168.143 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 94.1 mt -114.34 89.04 2.99 Favored 'General case' 0 N--CA 1.458 -0.073 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 168.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 73.3 p -77.77 55.76 1.42 Allowed 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 124.628 1.171 . . . . 0.0 109.366 -178.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 63.8 mt -87.21 -56.3 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 N-CA-C 106.732 -1.581 . . . . 0.0 106.732 177.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 71.26 -70.85 0.81 Allowed Glycine 0 CA--C 1.527 0.799 0 N-CA-C 110.618 -0.993 . . . . 0.0 110.618 179.061 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 56.1 m -71.24 76.0 0.72 Allowed 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 169.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 5.0 mttp -44.48 95.83 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 125.844 1.658 . . . . 0.0 112.385 -176.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.5 pp -59.58 -10.56 3.6 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 115.909 1.818 . . . . 0.0 115.909 -169.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -161.19 164.82 30.22 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 119.718 1.145 . . . . 0.0 108.177 169.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 -38.56 -42.82 0.8 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 127.246 2.218 . . . . 0.0 113.578 176.289 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.88 -60.85 0.16 Allowed 'General case' 0 N--CA 1.46 0.038 0 C-N-CA 126.22 1.808 . . . . 0.0 113.3 -177.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -67.64 -38.71 84.25 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.836 -171.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 1.6 mp -61.89 -53.38 48.86 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 N-CA-C 106.164 -1.791 . . . . 0.0 106.164 179.131 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 85.0 t -57.83 -44.46 86.26 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 C-N-CA 124.073 0.949 . . . . 0.0 110.552 -177.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.67 -50.61 73.23 Favored 'General case' 0 CA--C 1.528 0.116 0 CA-C-N 119.262 0.937 . . . . 0.0 111.202 173.263 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 63.2 mt -56.43 -38.22 71.29 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 119.115 -0.469 . . . . 0.0 111.446 178.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 23.3 mmt -69.38 -61.76 1.66 Allowed 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.117 0.871 . . . . 0.0 109.683 175.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -45.88 -40.47 10.04 Favored 'General case' 0 CA--C 1.52 -0.196 0 C-N-CA 126.96 2.104 . . . . 0.0 111.467 -175.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -38.29 -49.97 1.43 Allowed 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.964 1.305 . . . . 0.0 111.546 174.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 77.0 mt -56.69 -50.96 70.59 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 122.495 0.318 . . . . 0.0 110.186 -175.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -69.41 -44.9 70.46 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 123.268 0.627 . . . . 0.0 110.911 -179.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 16.9 ttm180 -55.65 -47.17 77.11 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 124.128 0.971 . . . . 0.0 110.16 -179.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -72.3 -56.29 5.74 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 178.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.0 ttmm 52.69 39.01 27.67 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.63 0.729 . . . . 0.0 109.137 -168.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 53.5 m-20 66.47 0.02 1.65 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 126.922 2.089 . . . . 0.0 114.617 -174.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 27.5 mm100 -82.93 155.65 23.94 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 119.176 0.898 . . . . 0.0 108.636 168.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -73.14 161.16 30.92 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.987 173.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.7 m -117.57 160.24 17.24 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 C-N-CA 126.063 1.745 . . . . 0.0 107.955 168.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -105.98 -175.02 2.68 Favored 'General case' 0 CA--C 1.528 0.121 0 C-N-CA 125.102 1.361 . . . . 0.0 111.741 178.32 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -47.86 -66.14 0.45 Allowed 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 124.328 1.051 . . . . 0.0 112.001 176.069 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.1 tp60 -60.76 -35.56 76.73 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 119.565 1.075 . . . . 0.0 111.453 -173.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -61.61 -47.18 86.61 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.548 -0.72 . . . . 0.0 110.983 175.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -54.74 -50.6 67.99 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.993 -0.442 . . . . 0.0 109.954 172.549 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.405 ' CG2' ' CG2' ' B' ' 74' ' ' ILE . 25.3 mm -57.16 -37.45 55.89 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 C-N-CA 122.97 0.508 . . . . 0.0 110.331 177.533 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 86.6 m -68.09 -39.3 82.91 Favored 'General case' 0 N--CA 1.456 -0.143 0 O-C-N 121.513 -0.742 . . . . 0.0 110.315 177.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 38.0 t80 -56.57 -54.99 39.51 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 173.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 49.2 mt -59.92 -40.0 87.39 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 120.726 0.298 . . . . 0.0 111.476 176.067 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -60.08 -49.64 76.32 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 -179.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.9 -44.96 91.4 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 123.178 0.591 . . . . 0.0 110.25 178.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 11.0 tp -50.52 -57.91 7.0 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.636 0.731 . . . . 0.0 109.734 174.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.45 -53.58 43.66 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 125.037 1.335 . . . . 0.0 110.303 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 39.4 ttm -52.06 -50.06 62.25 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 125.542 1.537 . . . . 0.0 111.026 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 93.3 mt -69.0 -54.9 17.63 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 CA-C-O 118.698 -0.668 . . . . 0.0 110.294 -174.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.451 0.1 OUTLIER -76.14 -35.46 59.21 Favored 'General case' 0 C--N 1.344 0.351 0 C-N-CA 119.051 -1.06 . . . . 0.0 113.398 -173.599 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.4 m-80 -85.13 63.29 8.02 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 106.593 -1.632 . . . . 0.0 106.593 168.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -43.92 -36.77 2.55 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.541 1.136 . . . . 0.0 112.505 -175.729 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.38 -47.46 0.21 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 127.015 2.126 . . . . 0.0 113.165 169.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 20.3 mt -45.44 -45.87 13.19 Favored 'General case' 0 C--O 1.225 -0.206 0 C-N-CA 123.974 0.91 . . . . 0.0 111.322 178.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 65.5 mttm -64.94 1.11 0.98 Allowed 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 -175.51 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.313 0 CA-C-O 116.227 -2.429 . . . . 0.0 115.245 179.241 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 12.1 tpt . . . . . 0 N--CA 1.474 0.743 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -76.64 76.2 3.31 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 121.412 0.625 . . . . 0.0 109.488 175.064 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -50.41 159.66 0.83 Allowed Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 124.999 1.319 . . . . 0.0 110.841 170.391 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -52.22 -49.35 17.68 Favored 'Trans proline' 0 N--CA 1.459 -0.538 0 C-N-CA 122.599 2.199 . . . . 0.0 112.1 -178.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.7 mt -58.09 -45.68 86.76 Favored 'General case' 0 C--O 1.226 -0.182 0 C-N-CA 120.624 -0.431 . . . . 0.0 111.03 174.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -58.07 -47.36 83.39 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 118.164 0.438 . . . . 0.0 109.835 -177.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 tp60 -60.61 -47.81 84.56 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 122.913 0.485 . . . . 0.0 110.896 177.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.66 -45.74 81.8 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.209 0.528 . . . . 0.0 111.46 -176.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 74.2 mt -54.14 -51.51 46.31 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 170.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.16 -47.46 20.85 Favored Glycine 0 CA--C 1.528 0.869 0 C-N-CA 124.797 1.189 . . . . 0.0 111.889 174.9 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 mt -56.26 -57.31 12.79 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 117.582 0.691 . . . . 0.0 110.635 174.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.6 mp -57.9 -41.18 82.08 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.047 0.84 . . . . 0.0 111.805 -177.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 74.0 mt -58.22 -56.41 16.27 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 C-N-CA 124.02 0.928 . . . . 0.0 110.741 172.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.64 -50.73 59.17 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 109.942 -1.263 . . . . 0.0 109.942 -176.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.8 mm -51.15 -50.58 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 C-N-CA 124.076 0.95 . . . . 0.0 110.107 173.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -54.05 -57.71 10.03 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 118.107 0.412 . . . . 0.0 110.222 179.088 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 41.9 m-70 -63.43 -29.23 70.55 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -176.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 64.5 tttp -50.45 -33.21 20.21 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 119.061 0.846 . . . . 0.0 111.841 176.096 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -108.62 -44.37 4.07 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.395 0.678 . . . . 0.0 111.083 177.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.2 m -75.26 -32.86 61.2 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.927 0.891 . . . . 0.0 112.751 -174.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.25 61.43 3.49 Favored Glycine 0 CA--C 1.523 0.591 0 C-N-CA 124.23 0.919 . . . . 0.0 111.944 -169.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 90.1 mttt -136.34 -157.59 0.8 Allowed 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 124.524 1.13 . . . . 0.0 109.361 -176.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -76.58 70.61 3.13 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.858 0.863 . . . . 0.0 111.264 -170.04 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -173.61 -161.75 24.33 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 109.239 -1.544 . . . . 0.0 109.239 176.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -77.81 94.53 4.52 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 177.076 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 36.2 mtmm -59.94 -14.19 14.59 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.032 1.333 . . . . 0.0 113.411 -170.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -77.14 -4.75 46.1 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.37 1.068 . . . . 0.0 111.829 174.006 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 20.2 p -137.93 164.69 28.39 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.442 1.097 . . . . 0.0 111.304 -172.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.5 175.67 12.48 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.801 1.24 . . . . 0.0 109.184 169.507 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.2 t -131.39 -163.17 1.29 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.499 1.12 . . . . 0.0 112.55 -176.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 6.4 mtpm? -39.71 -67.51 0.22 Allowed 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 128.515 2.726 . . . . 0.0 113.461 -169.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -60.94 -46.85 89.03 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 -169.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -54.35 -44.67 72.35 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.48 0.712 . . . . 0.0 110.747 177.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 30.5 mt -65.06 -47.06 78.65 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 118.065 0.393 . . . . 0.0 111.599 178.543 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 58.5 mttp -57.08 -46.48 82.5 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.647 175.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -57.66 -49.36 76.74 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 122.955 0.502 . . . . 0.0 110.397 175.684 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 10.4 mt -48.16 -53.47 16.68 Favored 'General case' 0 CA--C 1.527 0.09 0 CA-C-N 119.15 0.886 . . . . 0.0 110.25 178.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 39.8 mt -57.84 -62.09 1.08 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.297 175.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -50.04 -46.87 53.44 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.484 0.714 . . . . 0.0 112.534 -172.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 9.1 mmpt? -81.43 -52.33 7.38 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 125.342 1.457 . . . . 0.0 110.451 -172.198 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -95.75 -16.83 21.68 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 -168.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 54.3 mt -120.42 79.3 1.46 Allowed 'General case' 0 C--N 1.335 -0.033 0 C-N-CA 125.309 1.444 . . . . 0.0 108.154 173.712 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 59.4 p -79.11 47.9 0.82 Allowed 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.108 0.963 . . . . 0.0 109.72 -177.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 20.5 mt -83.71 79.99 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 -174.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -52.95 -47.03 60.37 Favored Glycine 0 CA--C 1.529 0.939 0 N-CA-C 109.967 -1.253 . . . . 0.0 109.967 171.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 7.0 m -72.26 65.72 0.62 Allowed 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.398 1.079 . . . . 0.0 110.295 172.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 62.8 mmtt -48.23 92.41 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.611 1.964 . . . . 0.0 112.293 -173.002 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 77.0 mt -60.47 120.28 9.63 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.358 1.063 . . . . 0.0 113.442 -169.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 65.98 -70.88 0.09 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 127.108 2.163 . . . . 0.0 113.708 168.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 18.0 p-10 179.38 -39.72 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 126.584 1.953 . . . . 0.0 109.148 -169.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.42 -61.33 0.14 Allowed 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 126.895 2.078 . . . . 0.0 113.831 -177.135 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -67.18 -38.71 85.86 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 120.804 0.335 . . . . 0.0 111.282 -172.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 2.1 mp -63.18 -53.89 40.31 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 N-CA-C 106.861 -1.533 . . . . 0.0 106.861 179.057 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 79.6 t -55.31 -45.35 77.79 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 C-N-CA 124.309 1.044 . . . . 0.0 110.134 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -58.17 -52.45 65.52 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 118.97 0.805 . . . . 0.0 110.203 176.364 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 62.9 mt -54.79 -39.5 68.51 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 119.43 -0.319 . . . . 0.0 111.418 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.83 -67.35 0.48 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 118.484 0.583 . . . . 0.0 109.524 173.727 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -39.62 -41.2 1.01 Allowed 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 127.364 2.266 . . . . 0.0 112.092 -176.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -37.88 -49.89 1.24 Allowed 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.162 1.385 . . . . 0.0 112.158 176.039 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -65.75 -33.7 76.47 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 111.699 0.259 . . . . 0.0 111.699 -174.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -76.8 -53.1 8.37 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 177.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 14.3 ttm180 -48.0 -41.57 25.7 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.311 1.044 . . . . 0.0 110.686 177.276 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -111.93 49.49 0.9 Allowed 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.911 0.884 . . . . 0.0 109.916 -178.298 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -72.36 65.57 0.63 Allowed 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.703 0.683 . . . . 0.0 111.184 176.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 69.17 47.98 0.7 Allowed 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 127.08 2.152 . . . . 0.0 110.284 -169.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 6.4 mp0 -128.58 155.93 44.15 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 169.515 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 64.8 mm-40 -105.2 113.87 27.73 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 106.042 -1.836 . . . . 0.0 106.042 169.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 12.3 m -79.25 142.28 14.22 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 176.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -82.41 170.31 15.44 Favored 'General case' 0 N--CA 1.461 0.108 0 C-N-CA 122.917 0.487 . . . . 0.0 111.578 177.395 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -35.37 -63.02 0.37 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.051 1.34 . . . . 0.0 112.82 173.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 10.1 tp-100 -64.53 -32.37 73.98 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 120.35 1.432 . . . . 0.0 111.817 -175.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -66.29 -39.38 89.32 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 120.966 -1.084 . . . . 0.0 110.274 176.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.03 -48.59 79.61 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 121.713 -0.617 . . . . 0.0 109.622 169.776 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.405 ' CG2' ' CG2' ' A' ' 74' ' ' ILE . 20.0 mm -62.18 -23.89 33.16 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 O-C-N 121.612 -0.68 . . . . 0.0 110.891 175.638 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 39.7 m -77.88 -33.72 51.89 Favored 'General case' 0 C--O 1.224 -0.273 0 O-C-N 120.762 -1.211 . . . . 0.0 110.426 171.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -60.16 -55.77 29.72 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.298 -0.876 . . . . 0.0 108.977 170.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 45.4 mt -62.8 -41.62 99.36 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-O 121.035 0.445 . . . . 0.0 111.773 177.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.9 -43.27 96.27 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.598 -1.001 . . . . 0.0 110.598 -178.231 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.55 -46.29 86.64 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.349 0.66 . . . . 0.0 110.209 174.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 6.8 tp -50.41 -58.14 6.39 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.403 0.621 . . . . 0.0 109.83 174.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.5 -52.81 35.1 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.86 1.264 . . . . 0.0 110.21 178.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 57.1 ttm -57.14 -47.43 81.17 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 124.19 0.996 . . . . 0.0 111.139 -178.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 97.1 mt -65.42 -58.63 6.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 -176.765 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.448 1.1 p90 -67.09 -40.58 86.99 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 118.218 -1.393 . . . . 0.0 112.501 -174.489 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 28.3 m-80 -81.71 66.98 7.51 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 169.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -44.0 -35.44 2.07 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.842 1.257 . . . . 0.0 113.815 -171.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -32.84 -53.3 0.34 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.537 1.535 . . . . 0.0 112.246 168.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 69.1 mt -72.37 0.83 9.07 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.787 1.032 . . . . 0.0 113.787 -171.648 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -68.49 73.31 0.23 Allowed 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 120.108 1.322 . . . . 0.0 109.866 174.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.375 0 CA-C-O 117.934 -1.481 . . . . 0.0 110.678 -177.664 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.0 ptm . . . . . 0 N--CA 1.475 0.822 0 N-CA-C 111.08 0.03 . . . . 0.0 111.08 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -130.24 112.55 13.46 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 173.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 40.0 p -73.68 170.58 13.68 Favored Pre-proline 0 N--CA 1.451 -0.38 0 C-N-CA 123.206 0.602 . . . . 0.0 110.059 175.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -50.58 -43.93 42.77 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.299 1.999 . . . . 0.0 110.658 168.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.8 mt -53.38 -61.06 2.54 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-O 119.234 -0.412 . . . . 0.0 111.531 170.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -56.9 -39.22 74.01 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 118.495 0.589 . . . . 0.0 111.172 -174.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 -61.19 -51.04 70.67 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.782 0.833 . . . . 0.0 110.686 175.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.22 -44.9 95.52 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.454 0.702 . . . . 0.0 111.323 -178.682 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 95.4 mt -54.87 -52.26 44.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 171.08 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.3 -47.43 21.71 Favored Glycine 0 CA--C 1.526 0.759 0 C-N-CA 125.309 1.433 . . . . 0.0 111.929 175.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 mt -55.14 -54.74 39.38 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 117.739 0.77 . . . . 0.0 110.43 174.022 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.6 mp -58.84 -44.17 90.89 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 119.344 0.975 . . . . 0.0 111.756 -179.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 88.5 mt -55.94 -56.53 12.24 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 C-N-CA 123.398 0.679 . . . . 0.0 110.304 174.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.19 -50.08 64.15 Favored Glycine 0 CA--C 1.522 0.471 0 N-CA-C 110.046 -1.221 . . . . 0.0 110.046 -176.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 8.8 mm -52.94 -47.86 52.54 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 C-N-CA 123.465 0.706 . . . . 0.0 110.139 175.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -55.25 -65.15 0.64 Allowed 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 118.432 0.56 . . . . 0.0 109.74 177.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 25.5 m-70 -61.92 -26.79 68.39 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 118.41 -0.805 . . . . 0.0 113.018 -172.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 65.1 tttp -49.21 -35.99 18.78 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 119.366 0.984 . . . . 0.0 111.107 171.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 71.7 m-85 -103.6 -56.34 2.23 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 122.994 0.518 . . . . 0.0 110.084 177.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.5 m -54.9 -34.17 62.8 Favored 'General case' 0 C--O 1.225 -0.231 0 C-N-CA 122.988 0.515 . . . . 0.0 111.924 -176.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -48.03 -30.07 7.06 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 124.91 1.243 . . . . 0.0 113.496 176.169 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 32.8 mtmm -65.48 -34.98 79.54 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 118.266 1.033 . . . . 0.0 111.253 177.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -74.2 135.23 42.76 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 178.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -54.81 -45.17 80.61 Favored Glycine 0 CA--C 1.531 1.038 0 N-CA-C 109.622 -1.391 . . . . 0.0 109.622 172.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -78.57 60.5 2.7 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.918 1.287 . . . . 0.0 109.453 172.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 3.2 ptmm? -65.57 -0.36 1.98 Allowed 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 115.394 1.627 . . . . 0.0 115.394 -171.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 20.8 t-160 -77.32 -17.77 58.03 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.419 1.088 . . . . 0.0 110.378 169.315 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -131.17 156.76 44.77 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 126.542 1.937 . . . . 0.0 110.374 -170.199 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.56 173.5 15.42 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.099 0.96 . . . . 0.0 109.171 173.057 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 54.5 p -117.94 171.97 7.72 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 123.596 0.759 . . . . 0.0 112.28 -172.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.7 pttm -31.74 -49.17 0.16 Allowed 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 127.197 2.199 . . . . 0.0 113.416 169.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.5 -54.83 42.55 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.411 0.624 . . . . 0.0 109.533 -177.109 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.2 mp0 -60.62 -41.91 95.8 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.339 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 69.6 mt -59.16 -48.77 80.37 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 118.447 0.567 . . . . 0.0 111.405 178.519 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -62.6 -31.57 72.43 Favored 'General case' 0 N--CA 1.457 -0.122 0 C-N-CA 123.397 0.679 . . . . 0.0 110.881 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.43 -68.83 0.34 Allowed 'General case' 0 C--O 1.22 -0.463 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 167.052 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.3 mt -30.13 -65.65 0.11 Allowed 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 126.075 1.75 . . . . 0.0 113.266 -177.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 20.0 tt -59.34 -51.94 66.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.231 -175.105 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -57.84 -45.76 85.74 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 125.208 1.403 . . . . 0.0 111.91 -177.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.0 mmpt? -72.21 -48.89 39.6 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 124.982 1.313 . . . . 0.0 110.263 -175.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -92.58 -52.77 4.48 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.306 0.642 . . . . 0.0 111.052 -169.201 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 31.9 mt -82.67 64.6 7.39 Favored 'General case' 0 C--N 1.335 -0.05 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 172.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 31.7 p -53.54 -67.9 0.22 Allowed 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.062 0.945 . . . . 0.0 109.768 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 53.5 mt 65.9 -60.9 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 127.611 2.364 . . . . 0.0 112.735 172.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.19 -69.06 1.98 Allowed Glycine 0 CA--C 1.526 0.723 0 N-CA-C 109.649 -1.38 . . . . 0.0 109.649 -177.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 20.0 m -72.12 71.39 0.84 Allowed 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.98 0.912 . . . . 0.0 108.999 173.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 31.8 mttt -54.34 96.84 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.157 0.983 . . . . 0.0 111.263 -171.077 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 73.8 mt -37.3 -45.59 0.68 Allowed 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 127.354 2.261 . . . . 0.0 113.804 -171.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -154.99 174.48 15.1 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 106.019 -1.845 . . . . 0.0 106.019 176.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -51.06 -30.59 16.21 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.914 1.286 . . . . 0.0 112.473 -177.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.31 -59.99 0.14 Allowed 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 126.984 2.114 . . . . 0.0 114.421 -176.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -63.63 -43.33 97.13 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 121.119 0.485 . . . . 0.0 110.332 -173.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 2.5 mp -63.1 -51.2 74.58 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 107.264 -1.384 . . . . 0.0 107.264 -178.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 72.7 t -55.11 -49.32 72.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 C-N-CA 123.554 0.742 . . . . 0.0 109.867 178.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -53.79 -53.07 57.5 Favored 'General case' 0 CA--C 1.527 0.092 0 CA-C-N 118.826 0.739 . . . . 0.0 110.595 176.338 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.4 mt -51.14 -43.0 61.12 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 119.34 -0.362 . . . . 0.0 111.737 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.48 -68.07 0.48 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 118.411 0.55 . . . . 0.0 109.85 175.38 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -43.86 -35.12 1.83 Allowed 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 128.037 2.535 . . . . 0.0 112.689 -174.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -38.39 -48.68 1.38 Allowed 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 124.738 1.215 . . . . 0.0 112.585 171.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -65.21 -36.7 84.99 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 117.877 0.308 . . . . 0.0 111.349 -176.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -71.04 -43.99 66.71 Favored 'General case' 0 C--O 1.226 -0.135 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 179.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 22.5 ttm105 -56.75 -52.9 63.2 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.195 0.598 . . . . 0.0 110.18 175.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 -81.04 60.99 4.44 Favored 'General case' 0 C--O 1.233 0.214 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -177.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 17.5 ttmm -74.65 69.88 1.79 Allowed 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.107 0.963 . . . . 0.0 109.763 -176.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 52.6 43.89 30.69 Favored 'General case' 0 CA--C 1.528 0.101 0 C-N-CA 124.908 1.283 . . . . 0.0 109.898 -169.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -141.44 149.62 41.23 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 125.788 1.635 . . . . 0.0 107.036 175.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -86.14 172.57 10.46 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.292 1.037 . . . . 0.0 109.269 169.387 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.6 m -119.13 149.21 21.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 169.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.8 p30 -93.2 169.15 10.61 Favored 'General case' 0 C--O 1.232 0.169 0 C-N-CA 123.677 0.791 . . . . 0.0 110.096 172.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -34.63 -59.0 0.48 Allowed 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 124.95 1.3 . . . . 0.0 113.261 176.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 34.6 tp60 -68.2 -29.25 68.05 Favored 'General case' 0 CA--C 1.528 0.116 0 O-C-N 120.848 -1.158 . . . . 0.0 111.464 -173.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.2 -31.7 66.12 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.408 -0.808 . . . . 0.0 110.063 174.085 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -61.16 -47.26 87.02 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.365 -0.834 . . . . 0.0 109.254 167.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 26.5 mm -59.96 -29.48 43.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 O-C-N 121.784 -0.572 . . . . 0.0 110.586 174.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 28.6 m -72.38 -39.15 68.25 Favored 'General case' 0 C--O 1.225 -0.195 0 O-C-N 121.26 -0.9 . . . . 0.0 111.225 172.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 48.1 t80 -58.83 -54.71 43.98 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 118.88 0.764 . . . . 0.0 109.454 174.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 29.2 mt -59.46 -44.97 92.88 Favored 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 122.477 0.311 . . . . 0.0 111.068 175.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -60.4 -39.86 96.79 Favored Glycine 0 CA--C 1.524 0.651 0 C-N-CA 123.727 0.679 . . . . 0.0 111.464 -178.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.99 -49.64 56.05 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.819 0.848 . . . . 0.0 110.057 176.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -47.38 -53.8 12.9 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.607 0.763 . . . . 0.0 109.731 173.632 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -54.62 -60.65 3.07 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 124.669 1.187 . . . . 0.0 110.6 176.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 53.9 ttm -48.93 -45.28 41.4 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 124.037 0.935 . . . . 0.0 111.333 -178.568 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 57.4 mt -65.82 -60.09 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-O 118.482 -0.77 . . . . 0.0 109.901 -178.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.379 0.0 OUTLIER -76.64 -31.61 57.48 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 113.96 1.096 . . . . 0.0 113.96 -172.67 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.7 m120 -82.39 58.02 3.92 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 169.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -39.53 -40.44 0.86 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 127.251 2.22 . . . . 0.0 115.046 -168.285 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -45.9 -38.41 7.45 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.914 1.286 . . . . 0.0 112.375 178.581 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 93.0 mt -55.89 -28.85 58.6 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -75.71 64.7 1.77 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.751 0.705 . . . . 0.0 109.609 174.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.148 0 CA-C-O 117.351 -1.805 . . . . 0.0 110.912 -177.02 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 24.9 ptm . . . . . 0 N--CA 1.475 0.822 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -81.34 67.34 7.24 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 122.894 0.478 . . . . 0.0 110.136 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.5 m -47.58 156.68 0.63 Allowed Pre-proline 0 CA--C 1.534 0.343 0 C-N-CA 126.245 1.818 . . . . 0.0 112.323 -179.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -41.65 -49.75 5.15 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 123.947 3.098 . . . . 0.0 114.25 -177.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 4.5 mt -56.19 -51.08 69.34 Favored 'General case' 0 N--CA 1.457 -0.111 0 N-CA-C 113.175 0.806 . . . . 0.0 113.175 172.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -61.68 -36.68 81.58 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 118.353 0.524 . . . . 0.0 109.85 -178.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -59.97 -53.8 53.57 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 124.396 1.078 . . . . 0.0 109.551 175.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.05 -47.41 86.53 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.102 0.961 . . . . 0.0 111.148 -178.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 72.0 mt -52.84 -53.0 23.37 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 170.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -49.29 -44.57 35.08 Favored Glycine 0 CA--C 1.525 0.676 0 C-N-CA 125.45 1.5 . . . . 0.0 111.882 176.864 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.1 mt -59.32 -54.45 46.67 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.651 0.78 . . . . 0.0 110.89 174.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 mp -58.49 -43.36 88.97 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 118.911 0.778 . . . . 0.0 111.43 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 85.4 mt -57.73 -52.65 55.04 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.207 0 C-N-CA 123.739 0.816 . . . . 0.0 110.611 173.012 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.25 -50.18 60.63 Favored Glycine 0 CA--C 1.523 0.551 0 N-CA-C 109.788 -1.325 . . . . 0.0 109.788 -177.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.9 mm -54.2 -50.81 53.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 C-N-CA 123.391 0.676 . . . . 0.0 110.387 175.216 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . 0.404 ' HB2' ' CE2' ' B' ' 73' ' ' TYR . 39.7 t80 -53.43 -56.59 15.58 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 121.699 0.762 . . . . 0.0 110.862 177.75 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 44.1 t60 -63.85 -37.4 87.25 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 124.573 1.149 . . . . 0.0 110.696 -171.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -49.67 -49.3 47.98 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.913 0.885 . . . . 0.0 110.91 175.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -88.42 -33.39 17.9 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 122.277 -0.264 . . . . 0.0 111.121 -174.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 14.6 m -63.46 -41.71 98.62 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 118.346 0.521 . . . . 0.0 110.721 175.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -23.05 -60.53 0.03 OUTLIER Glycine 0 C--N 1.339 0.697 0 C-N-CA 128.433 2.921 . . . . 0.0 114.397 -179.284 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 58.7 pttt -58.46 -41.5 85.3 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -172.375 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -87.1 36.15 0.72 Allowed 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.542 0.942 . . . . 0.0 113.542 -168.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 71.68 -68.52 0.99 Allowed Glycine 0 CA--C 1.53 0.995 0 C-N-CA 123.681 0.658 . . . . 0.0 112.625 171.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -78.34 71.54 4.81 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 178.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 56.9 pttt -71.26 27.33 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.612 1.565 . . . . 0.0 114.494 -171.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 18.0 m80 -128.94 11.15 6.03 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.964 1.705 . . . . 0.0 109.529 170.271 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 59.3 p -139.57 158.61 43.83 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.725 1.61 . . . . 0.0 107.624 172.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -161.4 179.01 8.61 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.057 171.457 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.3 t -135.68 -165.74 1.74 Allowed 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.659 1.118 . . . . 0.0 112.441 -176.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 24.1 pttm -47.14 -52.05 16.52 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 126.575 1.95 . . . . 0.0 112.618 -170.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 18.8 tptp -52.1 -51.31 58.55 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 124.247 1.019 . . . . 0.0 110.825 178.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 27.9 mp0 -69.21 -36.5 77.31 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.282 -176.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 19.2 mt -66.03 -47.67 73.62 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 118.842 0.746 . . . . 0.0 111.429 176.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -57.69 -48.72 78.76 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 175.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 58.2 mt-10 -53.04 -58.34 7.32 Favored 'General case' 0 C--O 1.222 -0.384 0 CA-C-O 119.363 -0.351 . . . . 0.0 110.914 172.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 10.2 mt -44.46 -62.56 1.14 Allowed 'General case' 0 CA--C 1.521 -0.165 0 C-N-CA 124.521 1.128 . . . . 0.0 110.229 179.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 15.3 tt -63.35 -47.01 93.96 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 C-N-CA 120.064 -0.654 . . . . 0.0 110.449 -174.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 16.0 tt0 -60.13 -49.34 78.02 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.409 -0.807 . . . . 0.0 111.717 -177.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -73.85 -52.15 13.94 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.838 0.855 . . . . 0.0 109.766 -175.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -85.15 -18.75 33.19 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -169.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 15.6 mt -133.47 60.54 1.7 Allowed 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 124.605 1.162 . . . . 0.0 108.364 175.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 7.0 p -52.51 -66.24 0.42 Allowed 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 123.773 0.829 . . . . 0.0 109.66 174.164 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 62.8 mt 69.03 -51.1 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 127.126 2.17 . . . . 0.0 112.312 175.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.13 -68.0 3.18 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 109.057 -1.617 . . . . 0.0 109.057 -178.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 42.5 p -75.12 69.06 1.97 Allowed 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 170.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 52.8 mttm -55.92 95.38 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.331 1.052 . . . . 0.0 110.875 -172.071 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 86.8 mt -46.65 118.07 1.88 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.667 1.587 . . . . 0.0 113.598 -169.17 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 69.43 -67.98 0.21 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 126.767 2.027 . . . . 0.0 113.165 168.673 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 179.78 -37.32 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 125.967 1.707 . . . . 0.0 110.556 -171.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -37.69 -56.47 1.06 Allowed 'General case' 0 C--O 1.225 -0.209 0 C-N-CA 125.383 1.473 . . . . 0.0 113.874 -171.002 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -61.21 -40.36 93.67 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.275 0.56 . . . . 0.0 110.88 -175.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 2.4 mp -68.44 -49.85 62.1 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 N-CA-C 106.873 -1.528 . . . . 0.0 106.873 -177.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 92.9 t -53.83 -45.06 62.12 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.263 0 C-N-CA 123.239 0.616 . . . . 0.0 110.141 175.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -57.17 -52.74 64.09 Favored 'General case' 0 CA--C 1.527 0.075 0 CA-C-N 118.715 0.689 . . . . 0.0 110.235 175.512 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 30.9 mt -52.51 -41.36 63.37 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 119.038 -0.505 . . . . 0.0 111.419 178.375 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 27.6 mmt -68.94 -61.9 1.61 Allowed 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.926 0.785 . . . . 0.0 109.914 176.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -44.11 -36.38 2.57 Favored 'General case' 0 CA--C 1.522 -0.131 0 C-N-CA 127.724 2.41 . . . . 0.0 111.899 -177.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -38.86 -49.42 1.65 Allowed 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 124.542 1.137 . . . . 0.0 112.061 175.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -57.87 -53.77 54.49 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.342 0.519 . . . . 0.0 109.909 -178.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -60.95 -39.63 90.25 Favored 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 124.352 1.061 . . . . 0.0 111.011 -178.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 36.0 ttm-85 -62.36 -54.94 33.06 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.473 0.709 . . . . 0.0 109.902 178.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 -69.8 -46.34 65.91 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-O 119.642 -0.218 . . . . 0.0 111.138 -173.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 47.8 mttp 52.23 36.13 18.61 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.272 0.558 . . . . 0.0 110.142 -169.029 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 37.4 m-20 57.47 24.82 10.69 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 125.705 1.602 . . . . 0.0 113.565 -174.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 69.4 mm-40 -101.97 159.92 14.94 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 123.632 0.773 . . . . 0.0 109.275 170.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 10.7 mp0 -77.63 115.98 17.82 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 124.615 1.166 . . . . 0.0 108.625 169.699 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 33.7 m -79.58 155.17 4.67 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 172.464 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 3.5 p30 -101.07 171.96 7.31 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.638 0.733 . . . . 0.0 110.527 171.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -31.8 -58.35 0.28 Allowed 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 126.627 1.971 . . . . 0.0 113.65 178.061 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 44.3 tp60 -65.9 -39.14 90.34 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.943 1.247 . . . . 0.0 112.201 -169.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -69.37 -38.78 78.22 Favored 'General case' 0 C--O 1.234 0.248 0 O-C-N 121.57 -0.706 . . . . 0.0 109.732 177.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 73' ' ' TYR . . . . . 0.404 ' CE2' ' HB2' ' B' ' 16' ' ' PHE . 1.0 OUTLIER -54.96 -55.47 30.37 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 171.77 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 19.3 mm -50.59 -48.34 26.89 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.26 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 178.336 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 34.2 m -59.88 -20.87 59.7 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -179.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 15.3 t80 -61.25 -49.31 77.62 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 119.48 1.036 . . . . 0.0 108.398 169.312 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 44.2 mt -71.3 -39.48 71.43 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.164 0.986 . . . . 0.0 110.936 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -58.31 -50.03 70.47 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.025 -1.23 . . . . 0.0 110.025 176.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.2 -45.68 93.58 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 122.817 0.447 . . . . 0.0 110.638 175.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 14.8 tp -51.46 -56.07 15.35 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.087 0.47 . . . . 0.0 110.075 177.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.42 -58.78 5.31 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 124.323 1.049 . . . . 0.0 109.896 175.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 55.6 ttm -50.63 -44.97 57.51 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.93 0.892 . . . . 0.0 111.315 -176.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 98.6 mt -70.19 -62.3 1.34 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 118.322 -0.846 . . . . 0.0 110.822 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.427 0.1 OUTLIER -71.38 -38.97 71.47 Favored 'General case' 0 C--N 1.347 0.476 0 C-N-CA 118.691 -1.204 . . . . 0.0 112.676 -170.919 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -85.98 62.54 7.51 Favored 'General case' 0 C--N 1.335 -0.048 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 168.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -42.72 -36.84 1.56 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.709 1.604 . . . . 0.0 112.573 -176.233 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -31.87 -49.68 0.18 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 126.804 2.042 . . . . 0.0 112.7 169.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 17.3 mt -47.36 -40.77 18.19 Favored 'General case' 0 C--O 1.226 -0.183 0 C-N-CA 124.561 1.144 . . . . 0.0 112.608 -179.592 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -59.87 -24.59 64.38 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.222 0.465 . . . . 0.0 111.898 -177.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.16 0 CA-C-O 117.595 -1.67 . . . . 0.0 111.072 176.249 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 82.3 mtp . . . . . 0 N--CA 1.476 0.853 0 CA-C-O 120.892 0.377 . . . . 0.0 110.595 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.96 78.02 0.05 OUTLIER 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.702 1.201 . . . . 0.0 110.202 178.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 14.9 m -64.5 164.5 19.38 Favored Pre-proline 0 CA--C 1.539 0.557 0 C-N-CA 125.137 1.375 . . . . 0.0 110.013 -176.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_exo -47.61 -47.95 16.87 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 123.171 2.58 . . . . 0.0 113.042 -178.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.2 mt -56.4 -47.49 78.89 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-O 119.195 -0.431 . . . . 0.0 112.036 173.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -61.66 -41.34 97.41 Favored 'General case' 0 C--O 1.227 -0.11 0 CA-C-N 118.717 0.689 . . . . 0.0 109.649 -176.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.5 tt0 -62.03 -49.78 74.64 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 122.855 0.462 . . . . 0.0 110.826 175.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.8 -46.34 89.97 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.534 0.683 . . . . 0.0 111.423 -178.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 68.8 mt -53.7 -52.31 35.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.196 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 170.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.87 -47.35 19.25 Favored Glycine 0 CA--C 1.526 0.769 0 C-N-CA 125.204 1.383 . . . . 0.0 111.88 175.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 mt -55.69 -54.86 39.13 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 117.706 0.753 . . . . 0.0 110.958 173.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.11 -44.35 87.65 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 118.809 0.731 . . . . 0.0 111.742 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 83.1 mt -56.81 -53.8 37.59 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 C-N-CA 123.422 0.689 . . . . 0.0 110.003 174.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -53.88 -50.22 55.45 Favored Glycine 0 CA--C 1.523 0.538 0 N-CA-C 110.111 -1.196 . . . . 0.0 110.111 -178.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 7.3 mm -55.33 -46.48 78.29 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 123.269 0.628 . . . . 0.0 110.513 176.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -56.23 -57.88 10.31 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 118.738 0.699 . . . . 0.0 110.233 175.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -56.41 -37.14 69.76 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 124.158 0.983 . . . . 0.0 111.234 -175.352 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -51.04 -32.16 20.77 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.801 1.24 . . . . 0.0 111.903 178.271 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -108.61 -53.44 2.64 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.108 0.563 . . . . 0.0 110.233 177.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 23.1 t -53.04 -37.89 61.96 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.458 0.703 . . . . 0.0 110.921 -179.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -50.72 -24.93 8.46 Favored Glycine 0 CA--C 1.53 1.003 0 C-N-CA 124.157 0.884 . . . . 0.0 114.076 176.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 54.5 mttp -91.85 -12.12 34.54 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 118.227 1.013 . . . . 0.0 112.355 -178.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -73.89 164.91 26.02 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.423 0.556 . . . . 0.0 109.504 176.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -64.49 -62.14 5.35 Favored Glycine 0 CA--C 1.53 0.973 0 N-CA-C 109.475 -1.45 . . . . 0.0 109.475 172.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -80.99 93.79 6.42 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 170.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 49.9 mtmt -74.33 34.91 0.09 Allowed 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 123.907 0.883 . . . . 0.0 112.912 -176.308 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 10.6 m80 -125.07 -7.9 7.15 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 127.019 2.128 . . . . 0.0 109.85 176.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 41.6 p -133.68 170.56 15.38 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 125.057 1.343 . . . . 0.0 108.516 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -161.36 170.8 19.42 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.548 1.139 . . . . 0.0 108.212 169.144 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 59.9 p -127.22 173.97 9.31 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 119.343 0.974 . . . . 0.0 112.482 -169.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.4 ptmm? -26.48 -55.9 0.08 Allowed 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 128.339 2.656 . . . . 0.0 114.565 175.074 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -55.63 -55.65 29.58 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 123.457 0.703 . . . . 0.0 110.233 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 7.7 mp0 -62.59 -35.64 80.16 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-O 118.949 -0.548 . . . . 0.0 110.49 -179.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 51.7 mt -66.69 -50.22 63.58 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 118.755 0.707 . . . . 0.0 111.217 178.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -59.77 -43.73 94.22 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 110.094 -0.335 . . . . 0.0 110.094 177.159 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -55.9 -64.83 0.73 Allowed 'General case' 0 C--O 1.219 -0.508 0 CA-C-O 118.467 -0.778 . . . . 0.0 109.646 170.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.3 mt -35.56 -62.16 0.42 Allowed 'General case' 0 N--CA 1.461 0.112 0 C-N-CA 125.42 1.488 . . . . 0.0 111.499 179.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 9.2 tt -60.81 -51.58 71.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 120.292 -0.563 . . . . 0.0 109.866 -174.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -60.61 -42.4 96.76 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.588 -0.695 . . . . 0.0 112.443 -177.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -72.67 -55.04 7.42 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.93 1.292 . . . . 0.0 109.534 -175.212 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -85.97 -24.97 26.3 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.735 0.814 . . . . 0.0 113.005 -168.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 67.9 mt -105.58 91.45 3.77 Favored 'General case' 0 C--N 1.338 0.099 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 168.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 60.9 p -78.14 50.7 0.92 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.175 0.99 . . . . 0.0 109.479 -179.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 69.4 mt -92.38 81.84 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 -173.381 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -55.63 -49.33 65.96 Favored Glycine 0 CA--C 1.529 0.922 0 N-CA-C 109.701 -1.359 . . . . 0.0 109.701 173.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 7.2 m -71.82 69.54 0.69 Allowed 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.213 1.005 . . . . 0.0 110.07 172.104 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 30.8 mmtp -45.73 95.44 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 126.151 1.781 . . . . 0.0 111.289 -178.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 93.8 mt -58.73 120.23 8.57 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.471 1.109 . . . . 0.0 113.515 -169.265 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 56.66 -96.56 0.06 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.873 1.669 . . . . 0.0 112.303 166.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -142.12 -40.3 0.36 Allowed 'General case' 0 N--CA 1.462 0.125 0 C-N-CA 124.076 0.951 . . . . 0.0 111.283 179.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -34.16 -57.98 0.47 Allowed 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 125.181 1.392 . . . . 0.0 113.81 -173.396 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 77.1 tt0 -66.04 -40.94 91.42 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.975 0.51 . . . . 0.0 111.486 -174.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 2.2 mp -63.05 -52.69 56.0 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.46 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 -179.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 77.6 t -54.36 -48.27 68.42 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 C-N-CA 123.975 0.91 . . . . 0.0 109.877 177.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -53.56 -52.94 58.1 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 118.871 0.759 . . . . 0.0 111.112 177.091 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 30.9 mt -52.59 -42.88 64.92 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 119.378 -0.344 . . . . 0.0 111.462 -179.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.52 -63.54 1.1 Allowed 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 118.457 0.571 . . . . 0.0 109.873 176.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -38.93 -46.35 1.3 Allowed 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 127.327 2.251 . . . . 0.0 111.818 -177.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -38.91 -48.81 1.62 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.701 1.2 . . . . 0.0 112.6 177.064 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.1 mp -57.39 -51.56 68.91 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 -177.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -65.94 -40.99 91.87 Favored 'General case' 0 C--O 1.225 -0.231 0 C-N-CA 122.654 0.382 . . . . 0.0 110.764 179.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 12.7 ttp180 -60.07 -41.76 93.08 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 122.842 0.457 . . . . 0.0 110.568 -178.072 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -87.37 -59.77 2.16 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-O 120.858 0.361 . . . . 0.0 111.333 -177.208 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 54.4 mttp 63.31 -73.04 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 126.005 1.722 . . . . 0.0 108.708 -166.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -138.05 -17.66 1.21 Allowed 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.94 1.696 . . . . 0.0 111.765 172.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 59.9 tp60 -71.37 129.7 39.48 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 118.703 0.683 . . . . 0.0 109.809 -174.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 21.1 mp0 -73.99 131.91 41.87 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 171.532 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.7 m -83.19 150.71 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 176.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -89.64 177.07 6.63 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 123.267 0.627 . . . . 0.0 110.693 175.058 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -44.43 -60.86 1.75 Allowed 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.84 0.856 . . . . 0.0 111.861 174.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.0 tp60 -62.49 -35.81 80.53 Favored 'General case' 0 C--O 1.225 -0.19 0 CA-C-N 119.376 0.989 . . . . 0.0 111.822 -173.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -65.51 -40.53 93.12 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 119.519 1.054 . . . . 0.0 111.277 174.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -55.62 -51.77 66.07 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.801 -0.562 . . . . 0.0 109.525 170.345 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 29.0 mm -56.53 -39.91 65.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 O-C-N 122.029 -0.419 . . . . 0.0 110.335 177.216 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 84.8 m -64.19 -39.59 94.31 Favored 'General case' 0 C--O 1.226 -0.151 0 O-C-N 121.614 -0.679 . . . . 0.0 110.384 178.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -55.27 -53.33 57.45 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 173.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 61.7 mt -60.32 -42.35 95.42 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.673 -0.24 . . . . 0.0 111.572 177.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -62.31 -46.9 92.93 Favored Glycine 0 CA--C 1.526 0.768 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 -179.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.6 -48.83 77.72 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 122.173 -0.604 . . . . 0.0 109.758 177.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 16.7 tp -50.37 -57.96 6.78 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.72 0.772 . . . . 0.0 110.029 176.052 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -48.42 -54.88 12.46 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 125.109 1.364 . . . . 0.0 109.955 177.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 9.1 ttp -59.99 -48.31 82.24 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 123.342 0.657 . . . . 0.0 111.655 -176.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 93.7 mt -59.55 -54.28 36.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 CA-C-O 118.135 -0.936 . . . . 0.0 110.128 -179.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.439 1.3 p90 -76.41 -38.72 55.18 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 120.097 1.317 . . . . 0.0 113.309 -175.742 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 27.8 m-80 -79.88 74.19 6.62 Favored 'General case' 0 N--CA 1.463 0.206 0 O-C-N 121.008 -1.058 . . . . 0.0 108.552 173.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -36.33 -43.19 0.36 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.309 1.444 . . . . 0.0 113.512 176.695 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -39.97 -41.96 1.29 Allowed 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.11 1.764 . . . . 0.0 113.54 174.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 47.6 mt -62.71 -28.41 69.93 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-O 118.864 -0.589 . . . . 0.0 112.349 -178.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.62 58.5 1.8 Allowed 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.553 1.07 . . . . 0.0 109.178 170.194 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.313 0 CA-C-O 116.38 -2.344 . . . . 0.0 110.256 179.547 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.915 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -71.26 78.06 0.72 Allowed 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.408 0.683 . . . . 0.0 111.005 -177.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.1 m -54.89 163.23 1.53 Allowed Pre-proline 0 CA--C 1.54 0.587 0 C-N-CA 124.686 1.194 . . . . 0.0 111.698 175.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -46.89 -50.33 10.99 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 123.597 2.864 . . . . 0.0 113.185 179.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.2 mt -54.73 -48.6 72.34 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-O 119.476 -0.297 . . . . 0.0 111.535 173.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -61.4 -42.38 98.63 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 118.315 0.507 . . . . 0.0 109.973 -176.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.2 tp60 -63.64 -47.22 82.23 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 122.367 0.267 . . . . 0.0 110.922 176.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.5 -47.19 82.75 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 121.339 0.59 . . . . 0.0 110.869 -178.012 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 69.5 mt -52.68 -55.34 11.76 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.248 0 N-CA-C 108.075 -1.084 . . . . 0.0 108.075 169.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -45.77 -45.97 13.41 Favored Glycine 0 CA--C 1.526 0.772 0 C-N-CA 125.352 1.453 . . . . 0.0 112.079 177.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.2 mt -55.72 -55.92 26.6 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.493 0.717 . . . . 0.0 110.782 173.371 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.9 mp -58.51 -43.03 88.97 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 118.898 0.772 . . . . 0.0 111.863 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 52.1 mt -57.48 -57.76 8.88 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 C-N-CA 123.435 0.694 . . . . 0.0 109.938 174.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.06 -48.84 61.53 Favored Glycine 0 CA--C 1.521 0.421 0 N-CA-C 109.968 -1.253 . . . . 0.0 109.968 -177.164 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 5.8 mm -54.22 -46.88 68.32 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 C-N-CA 123.515 0.726 . . . . 0.0 110.878 175.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -56.62 -61.42 2.44 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 118.719 0.69 . . . . 0.0 109.32 175.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -55.02 -37.33 66.51 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.727 0.811 . . . . 0.0 111.771 -173.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -45.68 -38.95 7.35 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.289 1.435 . . . . 0.0 111.197 175.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -101.56 -60.15 1.58 Allowed 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 176.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.5 m -50.63 -34.26 25.51 Favored 'General case' 0 C--N 1.338 0.091 0 C-N-CA 123.845 0.858 . . . . 0.0 112.617 -173.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -36.53 -48.35 1.24 Allowed Glycine 0 CA--C 1.527 0.786 0 C-N-CA 124.616 1.103 . . . . 0.0 112.745 173.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 10.6 ptpt -76.71 -13.94 59.99 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 113.191 0.812 . . . . 0.0 113.191 -171.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -74.53 -7.32 52.71 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.405 0.548 . . . . 0.0 112.046 -175.097 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 77.92 -60.77 3.78 Favored Glycine 0 CA--C 1.527 0.799 0 N-CA-C 109.421 -1.471 . . . . 0.0 109.421 -176.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -78.18 70.29 4.52 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 169.323 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 7.1 mttp -63.22 -7.84 6.91 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.433 1.093 . . . . 0.0 113.92 -169.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 11.9 t-80 -76.0 -15.42 60.15 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.877 0.871 . . . . 0.0 110.994 173.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 1.1 p -129.65 160.99 31.62 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 125.374 1.469 . . . . 0.0 110.715 -173.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -156.51 161.37 40.02 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.081 0.552 . . . . 0.0 111.449 169.496 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 75.5 m -108.2 158.76 17.16 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.649 1.18 . . . . 0.0 113.145 -174.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 14.5 ptpt -22.64 -58.35 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 129.048 2.939 . . . . 0.0 115.397 179.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 18.2 tppt? -46.52 -50.04 17.72 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.24 1.016 . . . . 0.0 111.094 179.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 80.1 mt-10 -69.67 -27.94 65.45 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 119.037 -0.506 . . . . 0.0 111.847 -178.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 19.7 mt -73.9 -46.37 44.92 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 119.153 0.888 . . . . 0.0 110.049 176.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 39.0 mttp -56.16 -47.87 77.41 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 172.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -55.04 -56.62 17.77 Favored 'General case' 0 C--O 1.223 -0.336 0 CA-C-O 119.044 -0.503 . . . . 0.0 111.037 172.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 11.1 mt -45.95 -59.56 2.76 Favored 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 123.38 0.672 . . . . 0.0 110.299 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 15.5 tt -62.91 -50.76 78.36 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 C-N-CA 119.8 -0.76 . . . . 0.0 110.197 -177.008 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -59.35 -51.1 71.39 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.078 -1.014 . . . . 0.0 112.302 -175.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.1 -52.82 12.82 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.736 0.815 . . . . 0.0 110.208 -177.091 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -88.99 -18.15 27.97 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 -167.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 42.6 mt -123.37 68.46 1.01 Allowed 'General case' 0 CA--C 1.526 0.054 0 C-N-CA 125.255 1.422 . . . . 0.0 107.874 172.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 74.8 p -55.68 -57.08 13.49 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.677 -176.33 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 80.2 mt 67.65 -61.51 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 C-N-CA 126.89 2.076 . . . . 0.0 111.982 172.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.14 -66.27 2.23 Favored Glycine 0 CA--C 1.527 0.812 0 N-CA-C 110.154 -1.178 . . . . 0.0 110.154 -177.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 36.0 p -70.47 78.93 0.56 Allowed 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.745 0.818 . . . . 0.0 109.032 173.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 31.3 mmtm -39.09 95.47 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 126.455 1.902 . . . . 0.0 111.597 178.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 95.6 mt -65.83 84.56 0.08 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.742 1.217 . . . . 0.0 112.308 -169.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 71.62 -66.86 0.28 Allowed 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 126.937 2.095 . . . . 0.0 113.001 167.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 18.1 p-10 -164.83 -46.66 0.03 OUTLIER 'General case' 0 C--O 1.225 -0.231 0 C-N-CA 123.705 0.802 . . . . 0.0 111.054 -169.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -42.52 -54.45 3.9 Favored 'General case' 0 C--O 1.225 -0.188 0 C-N-CA 123.912 0.885 . . . . 0.0 113.182 -169.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -59.42 -43.46 93.05 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.675 0.79 . . . . 0.0 110.848 -178.058 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.2 mp -63.22 -52.53 57.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 N-CA-C 106.927 -1.508 . . . . 0.0 106.927 -178.389 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 84.7 t -56.72 -43.93 80.43 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 C-N-CA 124.248 1.019 . . . . 0.0 110.295 179.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -57.29 -53.7 55.17 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 119.023 0.829 . . . . 0.0 110.03 175.13 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 30.8 mt -51.88 -44.16 63.62 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 119.184 -0.436 . . . . 0.0 111.088 178.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 27.2 mmt -65.97 -65.31 0.69 Allowed 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 109.524 -0.546 . . . . 0.0 109.524 176.116 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -40.72 -43.09 1.89 Allowed 'General case' 0 CA--C 1.52 -0.196 0 C-N-CA 127.826 2.45 . . . . 0.0 111.89 -175.155 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -38.7 -48.76 1.52 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.21 1.004 . . . . 0.0 112.312 176.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.4 pp -61.85 -37.84 85.99 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 117.915 0.325 . . . . 0.0 111.479 -175.862 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -76.18 -47.15 25.19 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 179.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 14.1 ttm180 -50.57 -41.46 54.34 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.244 0.617 . . . . 0.0 110.283 177.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -82.94 19.79 1.31 Allowed 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 39.2 mtmt -58.36 -33.07 69.15 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 120.156 1.344 . . . . 0.0 108.471 166.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -74.74 12.4 0.83 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.334 1.054 . . . . 0.0 112.788 172.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 72.62 -45.36 0.62 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 126.998 2.119 . . . . 0.0 113.214 177.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -139.79 162.43 35.17 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.655 1.182 . . . . 0.0 109.572 178.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 5.3 m -118.77 149.86 21.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 C-N-CA 124.991 1.316 . . . . 0.0 107.619 172.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -86.84 174.62 8.66 Favored 'General case' 0 CA--C 1.527 0.093 0 C-N-CA 124.272 1.029 . . . . 0.0 111.79 176.219 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 49.3 t80 -46.31 -61.91 1.58 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.717 0.807 . . . . 0.0 113.156 178.015 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 10.1 tp-100 -63.8 -32.49 74.02 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 120.183 1.356 . . . . 0.0 111.071 -177.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -62.61 -41.7 99.14 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 119.533 1.061 . . . . 0.0 110.938 175.079 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -57.96 -50.51 73.14 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.769 -0.582 . . . . 0.0 109.892 169.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 23.9 mm -60.18 -25.21 32.79 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 O-C-N 121.655 -0.653 . . . . 0.0 111.04 176.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 60.8 m -77.88 -32.94 52.15 Favored 'General case' 0 C--O 1.224 -0.24 0 O-C-N 120.917 -1.115 . . . . 0.0 110.37 173.4 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 30.8 t80 -58.46 -55.25 37.47 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 170.293 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 53.1 mt -63.09 -43.19 99.21 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 121.411 0.624 . . . . 0.0 111.7 178.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.88 -43.7 97.18 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.685 -0.966 . . . . 0.0 110.685 -177.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.29 -46.74 85.37 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 123.186 0.595 . . . . 0.0 110.031 174.253 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 13.8 tp -49.55 -56.18 10.82 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.426 0.631 . . . . 0.0 109.963 175.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.81 -58.63 5.87 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 114.624 -1.171 . . . . 0.0 110.384 177.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 48.3 ttm -51.01 -48.4 61.43 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 124.889 1.276 . . . . 0.0 110.983 -177.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 76.6 mt -63.8 -66.07 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 CA-C-O 118.8 -0.619 . . . . 0.0 109.458 -178.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.381 0.7 OUTLIER -70.13 -31.29 68.74 Favored 'General case' 0 C--N 1.345 0.411 0 C-N-CA 117.941 -1.504 . . . . 0.0 112.715 -169.764 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 22.5 m-80 -80.61 71.73 7.5 Favored 'General case' 0 C--O 1.231 0.12 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 170.03 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -35.75 -45.22 0.37 Allowed 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 125.821 1.648 . . . . 0.0 112.158 178.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -35.74 -48.61 0.55 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.968 1.707 . . . . 0.0 113.426 174.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 96.4 mt -65.06 -26.91 68.44 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.002 0.521 . . . . 0.0 112.393 -176.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 9.6 mtmp? -86.6 -47.32 9.3 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.381 0.672 . . . . 0.0 109.419 174.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.202 0 CA-C-O 116.883 -2.065 . . . . 0.0 110.262 -179.005 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.4 ttt . . . . . 0 N--CA 1.473 0.723 0 CA-C-O 121.382 0.611 . . . . 0.0 109.986 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -72.75 78.53 1.12 Allowed 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.025 0.53 . . . . 0.0 110.917 -176.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.4 t -44.87 155.63 0.39 Allowed Pre-proline 0 CA--C 1.534 0.336 0 C-N-CA 124.989 1.316 . . . . 0.0 111.08 169.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -50.23 -38.92 52.45 Favored 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 122.331 2.021 . . . . 0.0 111.533 169.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.9 mt -61.28 -54.0 49.62 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 118.649 0.659 . . . . 0.0 110.142 173.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -58.35 -38.96 78.26 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 117.656 0.207 . . . . 0.0 110.832 -175.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 15.1 tt0 -64.02 -52.3 60.12 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 124.783 1.233 . . . . 0.0 110.615 176.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.34 -45.42 91.29 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 121.367 0.603 . . . . 0.0 111.098 -178.126 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 68.0 mt -52.63 -52.63 25.43 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 169.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.4 -47.47 16.78 Favored Glycine 0 CA--C 1.528 0.893 0 C-N-CA 125.204 1.383 . . . . 0.0 112.202 174.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.6 mt -56.89 -55.31 36.08 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 117.95 0.875 . . . . 0.0 110.8 174.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.9 mp -59.37 -42.8 92.47 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 118.707 0.685 . . . . 0.0 111.7 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 73.5 mt -55.94 -56.82 10.71 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.167 0 C-N-CA 123.959 0.904 . . . . 0.0 109.746 172.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.29 -48.58 63.5 Favored Glycine 0 CA--C 1.522 0.518 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 -176.577 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 6.3 mm -54.73 -46.63 74.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 C-N-CA 123.396 0.678 . . . . 0.0 110.527 175.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -57.95 -53.45 58.04 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.645 0.736 . . . . 0.0 110.187 175.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.5 t-80 -57.43 -36.61 71.58 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.673 0.789 . . . . 0.0 111.302 -175.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.8 ttmm -52.86 -28.5 23.29 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.026 1.33 . . . . 0.0 111.87 178.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 61.3 m-85 -117.61 -73.52 0.64 Allowed 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.36 0.664 . . . . 0.0 109.602 176.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -53.35 -48.77 68.23 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 124.513 1.125 . . . . 0.0 110.432 -175.683 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -65.63 -4.84 20.74 Favored Glycine 0 CA--C 1.522 0.53 0 CA-C-O 118.598 -1.112 . . . . 0.0 113.615 -175.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 13.5 mmmm -85.41 -31.19 23.02 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 118.961 1.381 . . . . 0.0 111.103 173.853 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -82.77 152.04 25.88 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 118.623 0.647 . . . . 0.0 109.271 176.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -54.55 -40.29 69.38 Favored Glycine 0 CA--C 1.528 0.906 0 C-N-CA 123.436 0.541 . . . . 0.0 111.952 -173.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 11.8 p-10 -79.07 62.05 3.38 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.014 0.926 . . . . 0.0 109.15 174.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -52.27 -28.84 20.38 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.366 1.466 . . . . 0.0 113.208 -169.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 20.1 t-160 -76.25 -14.14 60.14 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.6 1.56 . . . . 0.0 111.656 -176.422 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.5 p -131.64 159.88 37.02 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 124.015 0.926 . . . . 0.0 112.178 -169.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.48 -172.31 3.5 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.411 1.484 . . . . 0.0 108.178 171.178 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 8.6 t -148.17 -168.93 3.21 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 119.899 1.227 . . . . 0.0 111.828 178.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 49.0 pttt -35.15 -57.14 0.58 Allowed 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 128.992 2.917 . . . . 0.0 114.376 -173.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 23.1 ttmm -58.3 -52.37 65.88 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 -177.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -63.22 -40.48 97.59 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.274 -176.54 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.2 mt -59.77 -52.71 64.32 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 118.133 0.424 . . . . 0.0 111.178 175.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 35.3 mtmm -59.91 -43.36 94.92 Favored 'General case' 0 CA--C 1.531 0.212 0 O-C-N 122.202 -0.311 . . . . 0.0 110.706 -179.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 85.1 mt-10 -56.87 -60.22 3.89 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-O 118.746 -0.645 . . . . 0.0 109.8 172.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.0 mt -40.11 -60.6 1.02 Allowed 'General case' 0 N--CA 1.461 0.096 0 C-N-CA 124.481 1.113 . . . . 0.0 111.323 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 18.3 tt -60.94 -51.54 72.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 C-N-CA 120.179 -0.608 . . . . 0.0 110.29 -177.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -59.92 -47.55 85.3 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 118.868 0.758 . . . . 0.0 111.815 -175.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.2 mmpt? -67.95 -57.98 5.29 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 125.539 1.535 . . . . 0.0 109.642 -176.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -83.25 -49.23 9.63 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.198 -168.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 15.0 mt -82.46 63.77 6.79 Favored 'General case' 0 C--O 1.231 0.086 0 N-CA-C 108.056 -1.091 . . . . 0.0 108.056 171.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.2 t -74.61 56.48 0.69 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.434 1.094 . . . . 0.0 109.579 174.08 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 16.2 mt -70.14 -40.99 78.89 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 C-N-CA 123.993 0.917 . . . . 0.0 109.045 176.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.0 -66.14 2.19 Favored Glycine 0 C--N 1.338 0.693 0 N-CA-C 110.413 -1.075 . . . . 0.0 110.413 179.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 49.8 m -72.27 71.46 0.89 Allowed 'General case' 0 N--CA 1.456 -0.159 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 170.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 46.2 mttm -52.46 97.12 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.673 1.189 . . . . 0.0 111.113 -173.084 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.4 mt -56.57 128.35 35.83 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.529 1.131 . . . . 0.0 112.842 -169.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? 60.65 -93.72 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.803 1.641 . . . . 0.0 111.841 168.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -148.42 -37.87 0.18 Allowed 'General case' 0 CA--C 1.528 0.133 0 C-N-CA 124.044 0.938 . . . . 0.0 111.761 177.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.92 -60.5 0.16 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.124 1.77 . . . . 0.0 115.115 -176.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -62.55 -40.18 95.99 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-O 121.421 0.629 . . . . 0.0 110.845 -174.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.4 mp -67.54 -48.42 76.94 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 -178.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 84.6 t -55.13 -44.66 75.53 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.36 0 CA-C-O 118.791 -0.623 . . . . 0.0 110.294 176.357 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -57.09 -52.68 64.33 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 119.339 0.972 . . . . 0.0 110.577 174.01 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 39.7 mt -52.99 -42.12 65.26 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 119.06 -0.495 . . . . 0.0 111.557 178.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 25.4 mmt -68.63 -61.56 1.77 Allowed 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.886 0.766 . . . . 0.0 109.554 176.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -46.12 -36.04 5.51 Favored 'General case' 0 CA--C 1.521 -0.143 0 C-N-CA 127.639 2.375 . . . . 0.0 111.973 -176.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -39.16 -56.75 1.43 Allowed 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.831 0.853 . . . . 0.0 111.605 170.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.25 -50.08 74.85 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 -176.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -58.25 -54.9 41.73 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.522 0.729 . . . . 0.0 111.189 -177.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 16.9 ptt180 -70.24 -43.15 71.17 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 122.493 -0.129 . . . . 0.0 110.789 -173.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 22.8 m120 -75.71 -57.73 3.71 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 119.251 -0.404 . . . . 0.0 110.405 -177.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . 0.319 16.9 ptpt 52.26 -73.84 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.659 1.584 . . . . 0.0 112.386 -167.949 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -146.91 35.08 0.92 Allowed 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.894 1.277 . . . . 0.0 110.373 170.059 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 58.7 tp60 -119.74 137.56 53.87 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 125.421 1.488 . . . . 0.0 109.697 -175.215 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.8 mp0 -77.7 141.92 39.08 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 124.193 0.997 . . . . 0.0 109.05 172.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 33.9 m -105.73 154.56 6.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 108.239 -1.022 . . . . 0.0 108.239 170.071 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -93.35 178.11 5.82 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 123.946 0.898 . . . . 0.0 110.967 177.114 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 50.3 t80 -40.51 -65.41 0.42 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.756 1.222 . . . . 0.0 112.538 172.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -61.21 -36.54 80.19 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 120.074 1.306 . . . . 0.0 111.844 -175.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 -66.55 -32.87 74.48 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 120.956 -1.09 . . . . 0.0 111.628 176.089 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -61.61 -51.89 66.65 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 121.19 -0.944 . . . . 0.0 108.559 168.499 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 21.3 mm -53.02 -39.69 33.91 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.364 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 177.713 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 54.6 m -59.1 -32.83 70.18 Favored 'General case' 0 C--O 1.226 -0.167 0 C-N-CA 123.744 0.818 . . . . 0.0 111.301 177.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -56.97 -50.55 72.3 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 171.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 42.9 mt -69.83 -39.82 76.24 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.018 0.927 . . . . 0.0 111.755 -177.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.72 -43.04 77.45 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 109.925 -1.27 . . . . 0.0 109.925 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.47 -45.95 88.44 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 122.104 -0.644 . . . . 0.0 110.202 173.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 10.0 tp -50.53 -57.69 7.54 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.04 0.536 . . . . 0.0 109.708 173.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -49.67 -54.14 20.36 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 124.072 0.949 . . . . 0.0 110.533 177.12 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 48.1 ttm -56.16 -47.94 77.27 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 124.248 1.019 . . . . 0.0 110.906 -177.116 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 85.5 mt -65.48 -55.43 20.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.477 -177.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.444 0.1 OUTLIER -75.22 -35.8 61.44 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 119.911 1.232 . . . . 0.0 112.997 -174.408 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 31.9 m-80 -81.75 72.85 8.8 Favored 'General case' 0 N--CA 1.461 0.105 0 O-C-N 120.942 -1.099 . . . . 0.0 108.123 170.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -30.17 -50.77 0.13 Allowed 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 126.633 1.973 . . . . 0.0 112.837 -179.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -34.11 -54.46 0.49 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.202 1.801 . . . . 0.0 113.146 174.264 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 94.7 mt -65.72 -7.17 14.17 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.086 0.954 . . . . 0.0 113.245 -173.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -69.82 -31.53 69.46 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 120.005 1.275 . . . . 0.0 110.104 169.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.127 0 CA-C-O 116.949 -2.029 . . . . 0.0 111.061 -177.42 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.801 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -58.62 86.32 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.838 1.255 . . . . 0.0 110.066 173.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -71.07 170.29 11.94 Favored Pre-proline 0 CA--C 1.539 0.526 0 C-N-CA 124.616 1.167 . . . . 0.0 111.101 -169.974 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -49.09 -49.01 16.37 Favored 'Trans proline' 0 N--CA 1.459 -0.554 0 C-N-CA 123.313 2.675 . . . . 0.0 112.428 179.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.5 mt -53.7 -50.9 64.88 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 119.32 -0.372 . . . . 0.0 111.551 172.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -59.38 -41.23 88.86 Favored 'General case' 0 C--O 1.227 -0.11 0 CA-C-N 118.539 0.608 . . . . 0.0 110.285 -177.376 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -61.66 -50.32 72.98 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 122.832 0.453 . . . . 0.0 110.69 176.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.21 -46.13 90.8 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.597 0.759 . . . . 0.0 111.164 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 78.5 mt -55.64 -50.87 64.18 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 172.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.69 -47.68 18.11 Favored Glycine 0 CA--C 1.527 0.787 0 C-N-CA 125.295 1.426 . . . . 0.0 111.896 174.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.3 mt -55.52 -54.59 42.06 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 117.538 0.669 . . . . 0.0 111.087 173.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.5 mp -58.21 -42.76 86.93 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 118.851 0.751 . . . . 0.0 111.616 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 97.4 mt -56.98 -53.32 44.48 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.168 0 C-N-CA 123.204 0.602 . . . . 0.0 110.082 173.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.77 -50.06 59.42 Favored Glycine 0 CA--C 1.522 0.525 0 N-CA-C 110.33 -1.108 . . . . 0.0 110.33 -178.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.8 mm -55.02 -45.84 76.96 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 C-N-CA 122.607 0.363 . . . . 0.0 110.28 175.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 39.7 t80 -56.94 -57.8 10.92 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 118.537 0.608 . . . . 0.0 110.111 176.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -51.66 -41.39 61.33 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 124.497 1.119 . . . . 0.0 111.128 -177.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 65.3 tttp -50.24 -32.63 17.12 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.337 1.055 . . . . 0.0 112.293 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -113.66 -55.17 2.54 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.495 0.718 . . . . 0.0 110.643 179.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 4.6 t -59.75 -38.11 80.85 Favored 'General case' 0 C--O 1.232 0.139 0 C-N-CA 124.159 0.984 . . . . 0.0 111.247 -178.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -75.89 37.05 1.25 Allowed Glycine 0 CA--C 1.527 0.84 0 O-C-N 121.754 -0.592 . . . . 0.0 113.788 -173.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 43.2 mttm -124.75 -20.75 4.96 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 126.636 1.975 . . . . 0.0 109.91 168.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -67.65 166.69 14.57 Favored 'General case' 0 N--CA 1.452 -0.325 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -65.23 -64.5 3.46 Favored Glycine 0 CA--C 1.528 0.844 0 N-CA-C 108.988 -1.645 . . . . 0.0 108.988 171.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 56.3 t0 -79.69 83.99 5.58 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 172.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 56.5 mttp -60.27 -13.13 11.07 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.684 1.194 . . . . 0.0 113.803 -175.209 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 16.8 t-160 -75.65 -14.62 60.37 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.164 0.986 . . . . 0.0 110.343 174.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 35.9 p -122.34 153.09 39.45 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 124.723 1.209 . . . . 0.0 112.609 -179.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -155.12 -174.68 5.08 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.672 1.589 . . . . 0.0 107.919 170.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 9.1 t -147.02 -167.47 2.78 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 120.155 1.343 . . . . 0.0 112.63 -177.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -39.96 -53.87 2.28 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 127.725 2.41 . . . . 0.0 113.474 -169.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -56.87 -50.57 72.09 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 123.015 0.526 . . . . 0.0 110.754 -179.042 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 19.4 mp0 -65.48 -38.1 88.78 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 -177.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 31.6 mt -66.45 -51.26 58.75 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 118.214 0.461 . . . . 0.0 111.268 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -54.91 -48.96 72.38 Favored 'General case' 0 N--CA 1.456 -0.175 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 176.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -52.61 -60.55 3.11 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 119.062 -0.494 . . . . 0.0 111.019 173.164 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 9.1 mt -43.04 -64.19 0.67 Allowed 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 124.466 1.106 . . . . 0.0 110.494 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 18.3 tt -63.22 -51.09 75.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 119.677 -0.809 . . . . 0.0 110.491 -174.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -67.91 -33.51 74.84 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.405 -0.809 . . . . 0.0 112.549 -171.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.43 -68.16 0.67 Allowed 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 174.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 60.8 mm-40 -64.25 -44.38 91.96 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 122.158 -0.339 . . . . 0.0 110.667 -168.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 26.3 mt -100.73 51.06 0.87 Allowed 'General case' 0 N--CA 1.456 -0.144 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 172.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 7.6 t -54.42 -30.28 51.93 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 167.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 8.3 tt 41.48 44.72 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 127.161 2.184 . . . . 0.0 113.855 166.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.59 -59.58 2.91 Favored Glycine 0 CA--C 1.529 0.953 0 N-CA-C 110.094 -1.202 . . . . 0.0 110.094 -172.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 43.0 p -157.74 -89.83 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 117.708 0.754 . . . . 0.0 111.981 169.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -135.99 72.09 1.43 Allowed 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 -170.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 14.7 tp -58.42 120.41 8.72 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 115.717 -0.674 . . . . 0.0 112.072 -174.058 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 61.86 -101.42 0.11 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 126.449 1.9 . . . . 0.0 110.812 170.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -147.3 -42.24 0.18 Allowed 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 124.916 1.287 . . . . 0.0 109.946 -174.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -33.55 -60.83 0.35 Allowed 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 125.87 1.668 . . . . 0.0 114.142 -178.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 62.8 tt0 -58.91 -41.39 87.14 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-O 120.959 0.409 . . . . 0.0 110.852 -178.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -64.59 -53.23 44.91 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.644 0 N-CA-C 106.665 -1.606 . . . . 0.0 106.665 -175.363 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 92.2 t -54.9 -45.58 75.62 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 C-N-CA 124.168 0.987 . . . . 0.0 110.082 177.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -55.75 -53.17 59.88 Favored 'General case' 0 CA--C 1.528 0.106 0 CA-C-N 118.538 0.608 . . . . 0.0 110.876 174.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 60.3 mt -55.85 -39.86 72.04 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 118.97 -0.538 . . . . 0.0 111.153 179.216 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 26.4 mmt -65.78 -65.6 0.66 Allowed 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.859 0.754 . . . . 0.0 109.186 174.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -39.3 -45.93 1.49 Allowed 'General case' 0 N--CA 1.461 0.124 0 C-N-CA 127.393 2.277 . . . . 0.0 111.892 -178.315 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -38.95 -48.3 1.57 Allowed 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 125.127 1.371 . . . . 0.0 112.227 178.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.2 pp -60.04 -39.89 87.52 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-O 119.641 -0.218 . . . . 0.0 110.827 -175.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -80.26 -42.81 22.47 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 123.005 0.522 . . . . 0.0 110.506 -178.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 54.7 ttm-85 -53.65 -45.73 70.32 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.328 0.651 . . . . 0.0 110.037 177.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 14.5 m-80 -80.7 -61.69 1.89 Allowed 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 178.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 36.5 ttmt 58.21 -82.92 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.194 1.398 . . . . 0.0 110.37 -172.367 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -142.2 36.03 1.53 Allowed 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.526 1.13 . . . . 0.0 109.678 173.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -136.45 146.12 45.99 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 125.007 1.323 . . . . 0.0 108.398 179.183 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 26.6 mp0 -70.66 166.0 21.7 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.148 0.979 . . . . 0.0 109.548 168.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 15.3 m -115.97 153.05 17.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 N-CA-C 106.106 -1.813 . . . . 0.0 106.106 167.369 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -96.82 174.83 6.6 Favored 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 123.085 0.554 . . . . 0.0 110.728 174.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -39.9 -60.23 1.05 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.065 0.946 . . . . 0.0 112.54 171.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 61.4 tp60 -60.48 -39.28 87.09 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 119.827 1.194 . . . . 0.0 111.835 -176.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 50.6 mm-40 -62.84 -41.37 99.32 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.322 -0.861 . . . . 0.0 111.339 174.141 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -56.7 -48.88 76.7 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.44 -0.787 . . . . 0.0 109.718 172.434 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 26.2 mm -59.42 -34.39 54.27 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 C-N-CA 123.725 0.81 . . . . 0.0 110.552 176.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 74.5 m -67.01 -41.91 85.88 Favored 'General case' 0 C--O 1.227 -0.121 0 O-C-N 121.479 -0.763 . . . . 0.0 110.204 174.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -56.72 -52.04 66.48 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.432 0.693 . . . . 0.0 109.225 174.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 44.0 mt -58.83 -44.64 90.96 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 122.246 -0.284 . . . . 0.0 111.59 175.042 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -59.5 -46.13 94.45 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 -179.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.09 -48.96 77.86 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 123.395 0.678 . . . . 0.0 109.804 176.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -50.69 -58.5 5.73 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-O 122.176 0.988 . . . . 0.0 109.733 176.201 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -48.69 -55.63 10.81 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 125.368 1.467 . . . . 0.0 110.742 178.126 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 19.7 ttp -66.58 -39.63 88.54 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.458 0.703 . . . . 0.0 112.087 -175.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 63.6 mt -65.49 -43.99 94.25 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 CA-C-O 118.02 -0.99 . . . . 0.0 110.079 -177.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.463 0.9 OUTLIER -78.75 -40.06 34.45 Favored 'General case' 0 C--N 1.347 0.459 0 C-N-CA 118.363 -1.335 . . . . 0.0 113.349 175.132 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -80.09 66.84 5.71 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 120.853 -1.154 . . . . 0.0 108.732 170.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -38.06 -42.65 0.67 Allowed 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.739 1.616 . . . . 0.0 113.328 -177.456 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -32.34 -55.07 0.33 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.25 1.82 . . . . 0.0 112.854 170.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 89.2 mt -62.23 -15.21 45.43 Favored 'General case' 0 C--O 1.222 -0.368 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 -173.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -65.61 -29.9 70.55 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.759 1.163 . . . . 0.0 111.195 174.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.202 0 CA-C-O 116.886 -2.064 . . . . 0.0 111.66 -174.034 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 45.3 ttp . . . . . 0 N--CA 1.477 0.877 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -67.05 81.25 0.12 Allowed 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.434 1.094 . . . . 0.0 110.907 -177.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.08 168.18 1.68 Allowed Pre-proline 0 CA--C 1.538 0.503 0 C-N-CA 126.598 1.959 . . . . 0.0 112.246 -178.384 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -49.05 -51.54 10.4 Favored 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 123.297 2.665 . . . . 0.0 112.491 174.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.8 mt -58.26 -49.18 78.02 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 119.436 -0.316 . . . . 0.0 110.705 176.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -54.99 -47.76 74.21 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -177.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 16.0 tt0 -59.72 -51.66 68.84 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.884 0.874 . . . . 0.0 110.757 177.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.33 -46.68 85.52 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.464 0.706 . . . . 0.0 111.725 -175.783 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 75.2 mt -54.21 -53.19 31.19 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 N-CA-C 107.958 -1.126 . . . . 0.0 107.958 170.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -45.6 -47.64 12.6 Favored Glycine 0 CA--C 1.529 0.92 0 C-N-CA 124.742 1.163 . . . . 0.0 112.087 175.07 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 mt -56.62 -54.3 47.63 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.785 0.834 . . . . 0.0 111.007 174.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.4 mp -60.03 -44.25 94.77 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.067 0.849 . . . . 0.0 111.743 -179.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 67.7 mt -56.18 -55.67 17.35 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 C-N-CA 123.238 0.615 . . . . 0.0 109.733 173.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -52.77 -50.73 48.54 Favored Glycine 0 CA--C 1.521 0.417 0 N-CA-C 110.03 -1.228 . . . . 0.0 110.03 -177.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.7 mm -55.0 -48.44 75.74 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 C-N-CA 123.03 0.532 . . . . 0.0 110.443 176.054 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -55.16 -56.15 23.2 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 118.668 0.667 . . . . 0.0 110.245 177.413 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -64.28 -31.96 73.37 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 123.19 0.596 . . . . 0.0 111.5 -172.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -49.77 -43.84 48.48 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.544 1.138 . . . . 0.0 110.828 176.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 94.5 m-85 -96.12 -56.05 2.77 Favored 'General case' 0 CA--C 1.529 0.138 0 N-CA-C 109.624 -0.509 . . . . 0.0 109.624 179.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.8 m -56.19 -31.58 63.57 Favored 'General case' 0 C--O 1.224 -0.267 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -175.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -51.17 -43.6 50.71 Favored Glycine 0 CA--C 1.527 0.829 0 O-C-N 121.667 -0.646 . . . . 0.0 112.36 175.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 15.8 pttm -86.36 53.23 2.73 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 118.042 0.921 . . . . 0.0 111.306 -174.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -165.0 154.78 13.26 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 126.014 1.726 . . . . 0.0 106.784 169.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -59.75 -52.19 54.48 Favored Glycine 0 CA--C 1.527 0.825 0 N-CA-C 111.292 -0.723 . . . . 0.0 111.292 -173.138 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 11.8 p-10 -79.51 54.1 1.69 Allowed 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.18 0.992 . . . . 0.0 110.665 -177.238 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -61.67 -9.8 7.04 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 115.699 1.74 . . . . 0.0 115.699 -169.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 16.5 m80 -78.53 -10.87 59.89 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.791 0.836 . . . . 0.0 110.578 175.315 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.4 p -138.89 164.51 29.48 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 127.059 2.144 . . . . 0.0 109.318 -174.041 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -161.61 163.2 30.12 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.829 0.852 . . . . 0.0 108.73 168.77 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 10.6 t -116.96 -169.64 1.68 Allowed 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.229 0.922 . . . . 0.0 112.639 -174.063 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -38.61 -65.49 0.35 Allowed 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 128.942 2.897 . . . . 0.0 113.252 -171.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 30.1 tttm -56.14 -43.54 78.36 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.386 0.674 . . . . 0.0 110.742 -174.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -66.41 -39.44 88.99 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 123.697 0.799 . . . . 0.0 110.387 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 45.8 mt -63.1 -50.65 69.66 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 118.123 0.42 . . . . 0.0 110.822 174.394 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 36.3 mttp -53.42 -49.26 67.69 Favored 'General case' 0 C--O 1.233 0.185 0 C-N-CA 123.584 0.754 . . . . 0.0 110.061 176.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 53.2 tt0 -51.56 -69.56 0.11 Allowed 'General case' 0 C--O 1.223 -0.335 0 CA-C-O 118.308 -0.853 . . . . 0.0 109.196 171.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.6 mt -35.26 -63.47 0.33 Allowed 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 124.126 0.971 . . . . 0.0 112.476 178.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 14.7 tt -63.85 -45.27 97.54 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-O 119.118 -0.468 . . . . 0.0 110.579 -171.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.0 tt0 -70.42 -44.75 67.28 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 118.856 0.753 . . . . 0.0 111.904 -176.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.7 mmpt? -54.85 -58.35 7.94 Favored 'General case' 0 N--CA 1.458 -0.069 0 C-N-CA 124.236 1.015 . . . . 0.0 109.103 175.842 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -79.56 -66.66 0.84 Allowed 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.715 -171.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 95.9 mt -87.99 56.32 3.82 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 121.615 -0.678 . . . . 0.0 109.916 -175.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.8 t -58.03 -33.34 68.87 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 168.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . 0.289 5.7 tt 43.37 68.47 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 C-N-CA 127.414 2.286 . . . . 0.0 112.224 168.32 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.15 -68.32 1.71 Allowed Glycine 0 CA--C 1.525 0.675 0 C-N-CA 125.306 1.431 . . . . 0.0 110.27 -179.14 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 30.9 t -173.64 55.89 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 125.925 1.69 . . . . 0.0 106.466 176.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 45.3 mttm 56.81 54.56 7.05 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.563 0.745 . . . . 0.0 110.88 -170.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.7 pp -66.57 133.45 50.35 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.146 -0.971 . . . . 0.0 110.361 174.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.2 tm0? 74.87 133.81 0.05 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 126.428 1.891 . . . . 0.0 110.968 178.044 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -47.0 -33.54 4.79 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 125.294 1.437 . . . . 0.0 114.552 -172.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -38.64 -56.2 1.35 Allowed 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.442 1.497 . . . . 0.0 113.737 -173.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -63.44 -38.93 93.04 Favored 'General case' 0 N--CA 1.461 0.106 0 CA-C-O 121.267 0.556 . . . . 0.0 110.709 -174.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 3.0 mp -68.65 -49.47 64.42 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.705 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 -175.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 71.6 t -53.5 -47.39 59.6 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 C-N-CA 123.342 0.657 . . . . 0.0 110.172 173.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.54 -52.63 63.06 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.73 0.695 . . . . 0.0 110.607 176.212 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.1 mt -55.27 -40.47 71.03 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.266 0.626 . . . . 0.0 111.547 -178.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.24 -61.49 1.77 Allowed 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 118.563 0.62 . . . . 0.0 109.645 174.491 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -46.61 -34.0 4.63 Favored 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 126.5 1.92 . . . . 0.0 112.269 -176.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -38.12 -50.39 1.38 Allowed 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 125.302 1.441 . . . . 0.0 111.43 173.212 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -53.03 -60.53 3.17 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 122.81 0.444 . . . . 0.0 109.872 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -63.34 -40.28 96.85 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.569 0.747 . . . . 0.0 111.467 -174.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -79.4 -30.2 42.32 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 119.485 -0.293 . . . . 0.0 111.761 -173.642 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -77.32 -50.17 13.41 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 118.512 0.596 . . . . 0.0 109.996 173.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 82.2 mttt 55.37 41.99 30.56 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 -167.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 68.57 -36.83 0.33 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.443 1.897 . . . . 0.0 113.806 -174.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -50.84 133.78 26.1 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.617 0.644 . . . . 0.0 109.928 172.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.5 pm0 -59.81 154.74 17.68 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 123.341 0.656 . . . . 0.0 111.312 171.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 20.5 m -107.69 149.1 11.31 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 C-N-CA 126.034 1.734 . . . . 0.0 108.303 174.349 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -87.68 168.93 12.56 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.335 0.654 . . . . 0.0 111.283 175.214 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -33.59 -63.0 0.27 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.688 1.195 . . . . 0.0 112.963 172.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 45.2 tp60 -62.49 -31.46 72.22 Favored 'General case' 0 CA--C 1.533 0.292 0 O-C-N 120.753 -1.217 . . . . 0.0 111.839 -174.186 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -71.8 -37.74 70.36 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.261 -0.899 . . . . 0.0 110.199 176.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -56.67 -49.86 73.81 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 169.666 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 26.9 mm -56.59 -41.43 73.5 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 175.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 60.1 m -59.22 -41.7 89.26 Favored 'General case' 0 C--O 1.225 -0.196 0 CA-C-N 118.821 0.737 . . . . 0.0 110.489 177.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -54.46 -54.62 38.46 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 122.027 -0.421 . . . . 0.0 109.885 174.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 62.4 mt -61.12 -40.7 94.78 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.95 -44.48 67.66 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 110.386 -1.086 . . . . 0.0 110.386 -176.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.02 -44.3 93.0 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 117.942 0.871 . . . . 0.0 110.302 175.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 14.4 tp -50.94 -57.1 9.41 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 121.278 0.561 . . . . 0.0 109.659 173.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.36 -47.32 66.21 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.312 178.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 37.2 ttm -58.49 -46.64 86.25 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 123.963 0.905 . . . . 0.0 110.798 -179.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 63.6 mt -63.51 -62.99 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.162 0 CA-C-O 118.554 -0.736 . . . . 0.0 109.886 176.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.452 0.2 OUTLIER -68.16 -34.74 76.88 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 118.025 -1.47 . . . . 0.0 112.731 -169.868 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -83.91 66.84 9.34 Favored 'General case' 0 N--CA 1.462 0.149 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 167.628 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 82.9 mt-10 -41.78 -39.31 1.7 Allowed 'General case' 0 N--CA 1.463 0.209 0 C-N-CA 125.904 1.681 . . . . 0.0 112.028 -173.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.17 -50.94 0.31 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.848 1.659 . . . . 0.0 113.419 171.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 59.5 mt -61.27 -18.62 59.35 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.926 0.89 . . . . 0.0 113.32 -174.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -67.36 -16.78 64.45 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 118.962 0.801 . . . . 0.0 112.038 172.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.258 0 CA-C-O 116.176 -2.458 . . . . 0.0 112.23 -179.468 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 12.8 tpt . . . . . 0 N--CA 1.474 0.738 0 N-CA-C 110.334 -0.247 . . . . 0.0 110.334 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -78.02 70.49 4.4 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 176.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 3.8 m -55.66 161.5 3.16 Favored Pre-proline 0 CA--C 1.54 0.559 0 C-N-CA 123.211 0.605 . . . . 0.0 110.797 174.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -44.26 -49.64 8.58 Favored 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 123.615 2.877 . . . . 0.0 113.285 178.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 6.1 mt -53.99 -47.82 71.02 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-O 119.643 -0.218 . . . . 0.0 111.466 174.158 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -64.93 -42.29 94.8 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 109.8 -0.445 . . . . 0.0 109.8 -174.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 tp60 -61.46 -46.69 89.01 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 122.179 0.192 . . . . 0.0 110.682 175.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.84 -46.88 83.06 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.411 0.685 . . . . 0.0 111.165 -178.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 57.8 mt -52.54 -51.99 29.95 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 C-N-CA 124.177 0.991 . . . . 0.0 108.448 169.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.68 -48.46 23.17 Favored Glycine 0 CA--C 1.528 0.874 0 C-N-CA 124.971 1.272 . . . . 0.0 111.654 175.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 mt -56.03 -54.51 44.03 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 117.492 0.646 . . . . 0.0 111.027 174.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 mp -57.94 -44.81 87.16 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.053 0.842 . . . . 0.0 111.666 -179.48 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 96.2 mt -56.32 -54.01 33.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 C-N-CA 123.171 0.588 . . . . 0.0 110.263 173.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.27 -50.19 57.01 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 110.293 -1.123 . . . . 0.0 110.293 -178.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 9.1 mm -53.85 -48.52 62.12 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 C-N-CA 123.684 0.794 . . . . 0.0 110.549 176.019 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -55.47 -62.28 1.78 Allowed 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.326 0.584 . . . . 0.0 109.686 176.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -52.7 -41.16 63.64 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.312 1.045 . . . . 0.0 111.427 -174.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -47.58 -39.96 17.97 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.713 1.205 . . . . 0.0 111.43 178.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -96.89 -62.48 1.25 Allowed 'General case' 0 C--O 1.233 0.199 0 N-CA-C 109.044 -0.725 . . . . 0.0 109.044 178.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.4 m -49.2 -44.09 42.9 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 124.135 0.974 . . . . 0.0 111.975 -173.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -44.54 -38.16 5.26 Favored Glycine 0 C--N 1.339 0.726 0 C-N-CA 124.972 1.272 . . . . 0.0 113.068 -177.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -72.71 -23.74 60.9 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -170.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -79.58 6.76 9.71 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -168.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 79.61 -51.75 4.04 Favored Glycine 0 CA--C 1.528 0.881 0 O-C-N 120.589 -1.319 . . . . 0.0 110.102 -176.488 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -78.29 59.46 2.31 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 107.694 -1.225 . . . . 0.0 107.694 168.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 65.8 mttt -41.58 -37.89 1.23 Allowed 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 127.378 2.271 . . . . 0.0 115.738 -166.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 45.2 m80 -99.47 17.27 20.73 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 -173.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -138.63 160.22 40.14 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 126.039 1.735 . . . . 0.0 107.412 176.724 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.53 176.87 11.12 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-O 118.998 -0.525 . . . . 0.0 110.938 176.369 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 39.1 p -125.71 174.0 8.62 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.701 0.682 . . . . 0.0 112.491 -174.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 11.3 ptpt -26.39 -56.65 0.08 Allowed 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 127.889 2.476 . . . . 0.0 113.981 170.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -53.78 -52.58 59.79 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 123.136 0.574 . . . . 0.0 110.551 -178.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 26.0 mp0 -67.8 -37.2 81.7 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 118.693 -0.67 . . . . 0.0 110.391 -178.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 62.3 mt -62.11 -51.96 65.8 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.266 0.939 . . . . 0.0 111.108 178.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -61.93 -42.13 98.75 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 122.987 0.515 . . . . 0.0 110.002 -179.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 58.9 mt-10 -54.87 -67.01 0.3 Allowed 'General case' 0 C--O 1.222 -0.353 0 CA-C-O 119.302 -0.38 . . . . 0.0 110.299 169.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 12.7 mt -37.61 -63.38 0.46 Allowed 'General case' 0 CA--C 1.52 -0.184 0 C-N-CA 125.98 1.712 . . . . 0.0 111.224 -179.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 13.6 tt -57.26 -54.38 31.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.158 -174.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 -73.7 -31.32 63.35 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.994 0.738 . . . . 0.0 112.994 -170.417 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.9 -56.98 4.2 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 176.336 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 68.9 mm-40 -77.06 -26.65 53.8 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 117.911 -1.042 . . . . 0.0 112.628 -168.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 95.5 mt -98.14 96.15 7.91 Favored 'General case' 0 C--N 1.339 0.11 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 167.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 55.5 p -76.27 42.56 0.27 Allowed 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.884 0.874 . . . . 0.0 110.862 -179.763 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 60.2 mt -87.66 72.77 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 N-CA-C 106.47 -1.678 . . . . 0.0 106.47 -177.307 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -51.07 -33.95 30.62 Favored Glycine 0 CA--C 1.532 1.105 0 CA-C-N 115.858 -0.61 . . . . 0.0 112.208 178.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 3.0 p -67.58 -20.48 65.38 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 124.835 1.254 . . . . 0.0 113.365 178.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp 47.93 60.31 3.65 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.413 1.085 . . . . 0.0 110.427 -173.393 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 97.4 mt -29.41 -56.58 0.15 Allowed 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 127.102 2.161 . . . . 0.0 115.466 -169.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -153.27 157.49 40.23 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 106.748 -1.575 . . . . 0.0 106.748 -172.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -33.54 -43.09 0.12 Allowed 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 128.369 2.668 . . . . 0.0 114.111 -172.204 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -28.7 -60.13 0.13 Allowed 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 126.453 1.901 . . . . 0.0 113.561 -178.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -67.65 -39.81 84.56 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-O 120.889 0.376 . . . . 0.0 110.603 -172.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.1 mp -62.05 -54.1 38.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 N-CA-C 106.931 -1.507 . . . . 0.0 106.931 179.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 70.9 t -58.71 -40.99 81.14 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 C-N-CA 124.452 1.101 . . . . 0.0 110.116 -177.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -58.19 -54.67 44.35 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 118.916 0.78 . . . . 0.0 110.307 172.198 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 36.7 mt -51.87 -41.87 62.21 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 119.231 -0.414 . . . . 0.0 111.606 178.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 24.0 mmt -69.56 -64.56 0.86 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 121.533 0.683 . . . . 0.0 109.988 177.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.65 -25.5 62.82 Favored 'General case' 0 N--CA 1.457 -0.088 0 C-N-CA 124.791 1.236 . . . . 0.0 112.293 -169.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -41.29 -50.09 3.69 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 124.273 1.029 . . . . 0.0 111.166 168.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 78.4 mt -59.08 -53.28 60.15 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -174.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -60.7 -44.03 97.07 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 124.582 1.153 . . . . 0.0 110.948 -179.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 29.4 ttm105 -59.05 -52.75 64.41 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.407 0.683 . . . . 0.0 110.108 178.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -76.14 -63.07 1.4 Allowed 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 116.663 -0.244 . . . . 0.0 110.372 -171.778 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 79.6 mttt 62.4 -75.31 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.261 1.425 . . . . 0.0 109.905 -167.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -143.21 8.37 1.61 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.435 1.494 . . . . 0.0 111.359 175.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -94.03 135.53 35.28 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.629 1.172 . . . . 0.0 108.43 -175.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -81.05 150.47 28.81 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 168.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 15.2 m -106.39 150.96 8.57 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 C-N-CA 124.697 1.199 . . . . 0.0 108.807 174.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -90.82 174.14 7.62 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.861 0.864 . . . . 0.0 110.826 173.81 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -39.06 -62.11 0.68 Allowed 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.019 1.328 . . . . 0.0 112.883 173.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 39.0 tp60 -61.84 -35.33 77.94 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 119.603 1.092 . . . . 0.0 111.605 -173.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -66.21 -43.42 86.77 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.667 -0.646 . . . . 0.0 110.139 176.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -54.67 -48.33 72.5 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.867 -0.52 . . . . 0.0 109.896 171.806 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 25.5 mm -58.55 -37.8 66.95 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 O-C-N 121.889 -0.507 . . . . 0.0 110.355 175.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 37.5 m -62.99 -42.86 99.96 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 121.521 -0.737 . . . . 0.0 110.203 175.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -56.14 -55.07 37.54 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 122.958 0.503 . . . . 0.0 110.017 176.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 39.6 mt -60.64 -44.28 96.58 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 122.188 -0.32 . . . . 0.0 111.861 177.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.56 -39.64 95.64 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 111.059 -0.816 . . . . 0.0 111.059 -175.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.32 -50.53 72.56 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 117.541 0.67 . . . . 0.0 109.425 173.118 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -49.39 -54.69 16.07 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 121.445 0.64 . . . . 0.0 109.894 174.658 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.08 -56.85 11.8 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 124.487 1.115 . . . . 0.0 110.716 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 11.4 ttp -60.74 -45.55 93.85 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.656 0.782 . . . . 0.0 111.315 -177.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 63.3 mt -61.97 -47.75 91.74 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-O 117.916 -1.04 . . . . 0.0 110.216 -175.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.453 0.0 OUTLIER -83.2 -31.58 27.0 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 179.89 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 32.0 m-80 -80.11 77.55 6.81 Favored 'General case' 0 N--CA 1.462 0.126 0 O-C-N 120.715 -1.241 . . . . 0.0 108.749 173.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 55.0 mm-40 -36.71 -43.29 0.41 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 126.024 1.729 . . . . 0.0 112.466 178.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -41.46 -41.19 1.99 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 126.185 1.794 . . . . 0.0 113.734 176.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 90.5 mt -75.35 -16.52 60.39 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -177.278 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 9.8 mtmp? -102.0 -44.66 5.41 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.295 1.038 . . . . 0.0 110.689 179.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.158 0 CA-C-O 117.424 -1.764 . . . . 0.0 110.329 -177.223 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 68.5 mtm . . . . . 0 N--CA 1.474 0.761 0 CA-C-O 120.407 0.146 . . . . 0.0 110.976 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -67.66 77.7 0.19 Allowed 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 121.894 0.854 . . . . 0.0 109.706 176.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 13.6 m -60.01 160.87 14.2 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 125.93 1.692 . . . . 0.0 109.717 -177.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo -48.61 -49.41 14.79 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.977 2.451 . . . . 0.0 112.92 -176.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.6 mt -58.83 -41.25 86.45 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 173.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -63.04 -40.79 98.77 Favored 'General case' 0 C--O 1.225 -0.201 0 CA-C-N 118.979 0.809 . . . . 0.0 109.389 -178.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -60.24 -51.87 67.72 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 122.753 0.421 . . . . 0.0 110.427 174.487 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.56 -46.87 88.59 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 121.563 0.697 . . . . 0.0 111.639 -177.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 60.6 mt -55.23 -50.8 61.6 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 171.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -48.06 -46.96 26.79 Favored Glycine 0 CA--C 1.526 0.747 0 C-N-CA 125.157 1.361 . . . . 0.0 111.688 176.029 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.6 mt -54.85 -55.93 24.95 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.775 0.83 . . . . 0.0 110.916 173.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 11.0 mp -60.35 -43.87 96.08 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.546 -0.721 . . . . 0.0 111.914 -179.025 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 96.1 mt -55.34 -56.16 13.04 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.206 0 C-N-CA 123.226 0.611 . . . . 0.0 109.592 173.431 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -52.77 -49.72 52.78 Favored Glycine 0 CA--C 1.522 0.483 0 N-CA-C 110.356 -1.098 . . . . 0.0 110.356 -177.271 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 7.9 mm -53.4 -46.94 59.05 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 C-N-CA 122.694 0.398 . . . . 0.0 110.84 176.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 29.3 t80 -58.87 -60.35 3.98 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 121.939 0.876 . . . . 0.0 109.8 176.342 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.1 t-80 -55.41 -34.14 64.15 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 125.468 1.507 . . . . 0.0 111.871 -172.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 65.3 tttp -46.68 -36.69 7.37 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.586 1.154 . . . . 0.0 111.567 174.425 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -104.88 -62.61 1.32 Allowed 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 176.002 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.5 m -51.4 -34.77 36.09 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 124.74 1.216 . . . . 0.0 112.705 -171.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -43.67 -33.66 2.45 Favored Glycine 0 C--N 1.34 0.757 0 C-N-CA 124.062 0.839 . . . . 0.0 113.222 178.511 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.02 -37.38 1.28 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.282 0.633 . . . . 0.0 112.265 178.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -78.68 69.3 4.84 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 121.432 -0.792 . . . . 0.0 109.984 -176.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 121.63 -103.15 0.85 Allowed Glycine 0 CA--C 1.523 0.566 0 N-CA-C 107.667 -2.173 . . . . 0.0 107.667 -176.451 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -155.6 152.57 28.91 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 173.258 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.42 -20.71 1.92 Allowed 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 -178.592 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 22.6 t-160 -89.4 -29.47 19.05 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 113.793 1.034 . . . . 0.0 113.793 172.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 36.4 p -138.3 139.77 39.26 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 -168.547 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -145.65 -172.84 3.98 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.413 1.085 . . . . 0.0 108.92 169.42 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 96.5 p -147.21 -179.86 7.13 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.813 1.188 . . . . 0.0 113.188 -170.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -19.18 -71.3 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 128.922 2.889 . . . . 0.0 115.132 -178.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.1 ttpt -60.38 -44.76 95.34 Favored 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 121.88 -0.512 . . . . 0.0 109.879 -172.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -59.97 -40.98 90.95 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 123.199 0.6 . . . . 0.0 110.084 177.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 38.0 mt -65.2 -49.99 67.61 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 118.121 0.419 . . . . 0.0 111.365 178.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -57.6 -51.25 70.25 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 178.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 59.1 tt0 -48.4 -57.75 5.6 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.988 1.315 . . . . 0.0 109.751 173.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.3 mt -46.36 -72.94 0.05 OUTLIER 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 124.306 1.043 . . . . 0.0 110.247 176.017 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 18.8 tt -55.54 -42.53 68.75 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 CA-C-N 117.787 0.267 . . . . 0.0 110.533 -169.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -56.38 -51.37 68.58 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.83 -0.544 . . . . 0.0 111.618 174.544 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.29 -54.07 24.1 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 118.12 0.418 . . . . 0.0 110.596 -174.04 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.14 -9.12 43.61 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -169.771 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 23.1 mt -129.81 69.27 1.43 Allowed 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 170.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 16.6 p -66.25 80.43 0.09 Allowed 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 169.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 9.6 tp -75.65 53.76 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 126.946 2.098 . . . . 0.0 112.153 -168.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 56.13 -82.73 0.01 OUTLIER Glycine 0 C--N 1.34 0.757 0 C-N-CA 126.955 2.217 . . . . 0.0 111.857 -178.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 35.3 m -154.58 46.46 0.56 Allowed 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 124.785 1.234 . . . . 0.0 108.61 174.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 8.7 mtmp? 75.63 61.55 0.05 Allowed 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 126.116 1.766 . . . . 0.0 110.118 -175.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 18.0 mt -47.3 -50.97 20.52 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 -178.594 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -152.8 143.1 22.51 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 -168.351 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -36.41 -43.54 0.39 Allowed 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 127.781 2.432 . . . . 0.0 115.523 -169.695 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -32.62 -62.01 0.25 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.535 1.534 . . . . 0.0 114.563 -174.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -65.23 -36.0 82.79 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-O 120.796 0.331 . . . . 0.0 111.093 -174.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.401 ' N ' ' CD1' ' A' ' 53' ' ' ILE . 1.3 mp -66.59 -52.75 42.55 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 N-CA-C 105.941 -1.874 . . . . 0.0 105.941 -176.267 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 86.4 t -53.38 -45.01 56.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 C-N-CA 124.173 0.989 . . . . 0.0 109.922 174.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.1 -50.39 73.65 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 118.92 0.782 . . . . 0.0 111.444 176.181 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 54.9 mt -56.06 -39.87 72.7 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 119.151 -0.452 . . . . 0.0 111.038 178.037 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 24.7 mmt -67.49 -60.35 2.64 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.808 0.731 . . . . 0.0 109.457 175.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -46.83 -40.17 13.31 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 126.89 2.076 . . . . 0.0 111.697 -176.23 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -38.78 -48.98 1.58 Allowed 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 124.908 1.283 . . . . 0.0 111.842 174.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 73.1 mt -58.45 -54.23 49.41 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.792 -0.448 . . . . 0.0 109.792 -176.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -66.01 -40.15 90.86 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 124.092 0.957 . . . . 0.0 111.275 -178.029 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 17.4 ttm180 -59.59 -48.97 79.59 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 123.895 0.878 . . . . 0.0 109.585 178.254 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -80.56 -69.74 0.58 Allowed 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 120.621 0.248 . . . . 0.0 110.578 -175.442 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 22.4 mtmm 63.9 -72.24 0.06 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 126.018 1.727 . . . . 0.0 108.152 -166.515 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -137.43 -18.62 1.26 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.172 1.789 . . . . 0.0 111.881 171.137 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.01 109.42 6.53 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 123.536 0.734 . . . . 0.0 110.26 -174.38 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -53.65 125.8 19.55 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 169.21 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 11.0 m -80.37 139.79 17.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 -179.047 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -83.17 172.09 13.0 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 120.988 0.423 . . . . 0.0 111.232 176.385 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -41.61 -59.48 1.62 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.577 1.151 . . . . 0.0 111.827 173.08 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 36.0 tp60 -61.12 -38.87 87.89 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 119.11 0.868 . . . . 0.0 111.564 -175.6 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -60.94 -44.6 97.02 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.532 -0.73 . . . . 0.0 110.807 174.347 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -58.08 -47.62 82.65 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 121.699 -0.626 . . . . 0.0 109.961 174.115 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.7 mm -59.08 -33.51 50.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 O-C-N 121.704 -0.622 . . . . 0.0 110.174 175.315 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 41.8 m -69.24 -36.2 76.92 Favored 'General case' 0 C--O 1.224 -0.287 0 O-C-N 121.448 -0.782 . . . . 0.0 110.402 173.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -58.52 -56.88 16.4 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 173.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 33.1 mt -60.7 -45.2 95.09 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 122.451 0.3 . . . . 0.0 111.781 178.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.65 -43.97 95.64 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.742 -0.943 . . . . 0.0 110.742 -176.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.02 -45.48 81.36 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 121.961 -0.729 . . . . 0.0 110.139 176.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -48.73 -55.71 10.66 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.469 0.708 . . . . 0.0 109.872 171.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -53.37 -54.8 31.4 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 124.28 1.032 . . . . 0.0 111.092 178.114 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 21.7 ttp -63.02 -36.26 82.97 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 123.995 0.918 . . . . 0.0 111.774 -176.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 83.1 mt -64.31 -60.66 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 176.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.439 0.2 OUTLIER -67.79 -35.7 79.11 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 117.188 -1.805 . . . . 0.0 112.638 -173.374 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 44.6 m-80 -80.1 65.8 5.37 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 169.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -35.38 -46.94 0.4 Allowed 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 126.413 1.885 . . . . 0.0 111.968 -176.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -27.64 -58.25 0.11 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.711 2.004 . . . . 0.0 113.307 171.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.7 mt -60.48 -19.5 56.9 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -172.243 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -67.68 -29.85 69.23 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 119.008 0.822 . . . . 0.0 111.488 174.174 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.207 0 CA-C-O 117.491 -1.727 . . . . 0.0 112.845 -169.703 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 5.0 ppp? . . . . . 0 N--CA 1.475 0.794 0 CA-C-O 119.862 -0.113 . . . . 0.0 110.806 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -110.35 99.34 8.38 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.777 0.831 . . . . 0.0 108.952 178.473 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 46.1 p -69.66 166.7 28.85 Favored Pre-proline 0 N--CA 1.452 -0.366 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 171.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_exo -49.37 -44.95 32.43 Favored 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 122.438 2.092 . . . . 0.0 110.986 168.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 2.1 mt -56.28 -58.36 8.3 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 118.621 -0.704 . . . . 0.0 112.475 170.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -56.61 -38.8 72.56 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 119.162 0.892 . . . . 0.0 110.481 -174.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 -61.4 -51.47 68.61 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.952 0.901 . . . . 0.0 111.194 173.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.73 -46.2 90.66 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.631 0.729 . . . . 0.0 111.362 -178.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 82.4 mt -53.03 -52.1 32.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 C-N-CA 124.597 1.159 . . . . 0.0 108.048 169.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.53 -47.66 22.93 Favored Glycine 0 CA--C 1.527 0.818 0 C-N-CA 124.94 1.257 . . . . 0.0 111.903 174.211 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.6 mt -54.48 -56.47 18.42 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.719 0.808 . . . . 0.0 110.408 173.292 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -56.79 -43.31 80.77 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 118.663 0.665 . . . . 0.0 111.69 -179.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 99.3 mt -58.42 -54.41 33.26 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 C-N-CA 123.007 0.523 . . . . 0.0 110.681 173.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.76 -49.93 67.08 Favored Glycine 0 CA--C 1.522 0.519 0 N-CA-C 110.313 -1.115 . . . . 0.0 110.313 -177.156 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 8.1 mm -51.25 -51.66 22.23 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 C-N-CA 124.182 0.993 . . . . 0.0 109.843 173.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -54.17 -56.44 18.21 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 110.172 -0.306 . . . . 0.0 110.172 177.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -58.04 -38.15 75.7 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 123.754 0.821 . . . . 0.0 111.241 -175.236 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 64.2 tttm -50.37 -42.82 53.92 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.824 0.849 . . . . 0.0 111.118 179.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -98.32 -30.42 12.6 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 122.781 0.432 . . . . 0.0 112.029 -178.365 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 14.2 m -69.6 -34.3 73.92 Favored 'General case' 0 C--O 1.226 -0.133 0 O-C-N 121.861 -0.524 . . . . 0.0 110.925 178.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -72.49 53.75 1.56 Allowed Glycine 0 CA--C 1.527 0.814 0 C-N-CA 124.597 1.094 . . . . 0.0 112.077 177.434 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt -147.72 -56.24 0.23 Allowed 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 124.939 1.295 . . . . 0.0 110.27 -177.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -127.28 161.41 28.65 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.254 1.021 . . . . 0.0 111.369 -168.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 54.91 -144.79 30.74 Favored Glycine 0 CA--C 1.529 0.938 0 C-N-CA 124.064 0.84 . . . . 0.0 111.912 175.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -78.73 132.6 37.02 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 105.369 -2.085 . . . . 0.0 105.369 168.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 28.0 mmtp -71.68 5.01 2.71 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 -168.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 14.7 m80 -113.99 20.93 15.32 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.588 1.155 . . . . 0.0 110.232 168.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 53.8 p -134.06 166.97 21.49 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 125.298 1.439 . . . . 0.0 107.522 169.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -160.77 160.25 31.05 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 171.55 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -100.93 176.74 5.17 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.42 1.488 . . . . 0.0 113.009 -169.589 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -42.72 -52.17 5.04 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 126.533 1.933 . . . . 0.0 113.825 179.13 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -62.81 -47.63 82.62 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 -175.22 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -59.29 -40.56 86.57 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.701 0.8 . . . . 0.0 111.187 177.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 35.5 mt -64.44 -48.1 76.58 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 118.471 0.578 . . . . 0.0 111.311 175.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 9.0 mtmp? -57.86 -43.24 85.83 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.951 -0.468 . . . . 0.0 110.297 175.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -55.28 -57.91 9.88 Favored 'General case' 0 C--O 1.224 -0.245 0 CA-C-O 119.189 -0.434 . . . . 0.0 110.553 171.076 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 10.7 mt -44.22 -59.39 2.38 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 123.898 0.879 . . . . 0.0 110.242 -179.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 16.0 tt -64.64 -51.43 67.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 C-N-CA 119.683 -0.807 . . . . 0.0 110.297 -177.47 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.24 -32.59 74.24 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 120.959 -1.088 . . . . 0.0 112.887 -172.42 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.11 -58.5 2.54 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.194 0.998 . . . . 0.0 109.937 177.611 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 49.7 mm-40 -82.78 -24.79 33.27 Favored 'General case' 0 CA--C 1.529 0.171 0 O-C-N 121.449 -0.782 . . . . 0.0 112.966 -168.395 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 58.4 mt -115.87 45.05 1.79 Allowed 'General case' 0 N--CA 1.46 0.065 0 C-N-CA 124.958 1.303 . . . . 0.0 108.02 169.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 1.8 t -56.21 -45.32 79.91 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 119.368 -0.349 . . . . 0.0 110.807 -173.259 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 63.5 mt 67.24 -56.69 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 C-N-CA 125.562 1.545 . . . . 0.0 113.623 169.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.98 -68.43 1.97 Allowed Glycine 0 CA--C 1.524 0.595 0 N-CA-C 109.438 -1.465 . . . . 0.0 109.438 -176.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 12.8 m -69.48 73.95 0.37 Allowed 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.314 1.046 . . . . 0.0 109.591 172.684 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 18.6 mmtm -45.99 93.29 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.105 1.762 . . . . 0.0 110.746 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 87.8 mt -51.42 -54.7 24.12 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 124.8 1.24 . . . . 0.0 112.114 -169.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -167.05 161.18 14.66 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 106.406 -1.702 . . . . 0.0 106.406 -172.299 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -37.03 -40.61 0.3 Allowed 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 128.024 2.53 . . . . 0.0 114.777 -171.53 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.4 -60.08 0.15 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.682 1.593 . . . . 0.0 114.45 -176.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 62.3 tt0 -63.55 -44.06 95.26 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 122.756 0.422 . . . . 0.0 110.81 -176.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.2 mp -59.96 -50.06 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.459 0 N-CA-C 106.461 -1.681 . . . . 0.0 106.461 -176.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 75.0 t -55.96 -54.62 24.84 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.535 176.528 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.41 -51.04 28.56 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 118.555 0.616 . . . . 0.0 111.764 -179.641 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 27.7 mt -52.19 -40.86 62.11 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 122.703 0.401 . . . . 0.0 112.06 -178.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -81.06 -58.48 3.05 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.625 0.77 . . . . 0.0 110.582 179.751 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -40.98 -42.61 1.93 Allowed 'General case' 0 N--CA 1.462 0.133 0 C-N-CA 126.484 1.914 . . . . 0.0 111.418 177.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -38.41 -51.64 1.55 Allowed 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 125.123 1.369 . . . . 0.0 112.897 174.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -58.15 -50.54 73.15 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -174.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -64.49 -49.04 72.92 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.683 0.393 . . . . 0.0 110.445 179.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 13.7 ttm180 -50.99 -54.2 26.49 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 124.113 0.965 . . . . 0.0 110.073 -179.154 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -68.08 -51.48 46.04 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 119.135 -0.46 . . . . 0.0 110.638 -179.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . 0.301 6.2 ptpp? 52.62 -74.55 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.933 1.693 . . . . 0.0 112.515 -169.167 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -146.82 34.69 0.92 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.039 1.336 . . . . 0.0 110.042 173.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -123.58 137.26 54.78 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.559 1.144 . . . . 0.0 110.009 -174.167 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -87.29 117.22 25.9 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 169.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 19.7 m -79.06 145.8 8.91 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.225 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 -177.328 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -82.77 177.7 8.54 Favored 'General case' 0 CA--C 1.528 0.133 0 C-N-CA 123.925 0.89 . . . . 0.0 111.377 177.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -48.16 -63.31 1.11 Allowed 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 123.963 0.905 . . . . 0.0 112.209 178.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 43.2 tp60 -61.99 -34.18 75.69 Favored 'General case' 0 CA--C 1.531 0.245 0 O-C-N 121.138 -0.976 . . . . 0.0 111.13 -174.03 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 61.3 mt-10 -63.24 -45.54 91.11 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 121.569 -0.707 . . . . 0.0 110.75 174.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -54.61 -49.11 71.24 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 121.645 -0.659 . . . . 0.0 109.98 170.799 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 22.4 mm -57.94 -34.47 48.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 O-C-N 121.689 -0.632 . . . . 0.0 110.343 176.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 33.2 m -67.9 -39.74 83.57 Favored 'General case' 0 CA--C 1.53 0.206 0 O-C-N 121.343 -0.848 . . . . 0.0 110.541 175.425 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -53.8 -55.19 28.7 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.656 -0.652 . . . . 0.0 109.63 171.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 34.9 mt -60.16 -45.32 93.46 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.791 178.707 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.0 -42.25 98.29 Favored Glycine 0 CA--C 1.524 0.623 0 N-CA-C 110.787 -0.925 . . . . 0.0 110.787 -176.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.43 -50.17 68.59 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 123.273 0.629 . . . . 0.0 110.108 175.719 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -48.14 -56.66 7.3 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 121.775 0.798 . . . . 0.0 110.136 173.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.81 -54.1 39.01 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.015 1.326 . . . . 0.0 110.695 179.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 50.1 ttm -57.32 -48.67 78.37 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.232 1.013 . . . . 0.0 110.619 -179.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 61.9 mt -63.36 -51.43 71.01 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-O 117.585 -1.198 . . . . 0.0 109.653 -174.212 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.436 0.8 OUTLIER -73.58 -39.69 64.46 Favored 'General case' 0 C--N 1.347 0.482 0 C-N-CA 118.15 -1.42 . . . . 0.0 112.707 -179.561 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -80.59 63.09 4.9 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 169.06 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -51.33 -25.22 5.58 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.102 0.961 . . . . 0.0 113.058 -172.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -39.55 -50.51 2.2 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.832 1.253 . . . . 0.0 111.49 167.107 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 86.1 mt -66.8 -3.37 6.63 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.689 1.196 . . . . 0.0 113.535 -176.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -73.55 -23.1 59.93 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 120.11 1.323 . . . . 0.0 109.732 168.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.2 0 CA-C-O 116.924 -2.042 . . . . 0.0 110.078 178.83 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.2 ptm . . . . . 0 N--CA 1.478 0.961 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -71.65 81.85 0.84 Allowed 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 177.393 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 70.0 p -54.4 162.93 1.44 Allowed Pre-proline 0 CA--C 1.533 0.319 0 C-N-CA 124.348 1.059 . . . . 0.0 111.21 174.03 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -47.99 -46.59 21.55 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.356 2.038 . . . . 0.0 110.676 168.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.7 mt -55.11 -59.28 4.98 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-O 119.26 -0.4 . . . . 0.0 111.716 173.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -52.55 -48.14 66.32 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.13 0.423 . . . . 0.0 110.336 -176.021 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.85 -49.98 75.27 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.499 0.72 . . . . 0.0 110.258 -179.558 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.49 -45.69 91.87 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.949 0.9 . . . . 0.0 111.99 -177.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 84.8 mt -55.14 -50.92 59.91 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 N-CA-C 107.737 -1.209 . . . . 0.0 107.737 171.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -45.56 -49.14 11.92 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 124.505 1.05 . . . . 0.0 112.033 172.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.6 mt -56.88 -55.15 38.16 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.055 0.927 . . . . 0.0 111.303 175.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -59.85 -44.42 94.13 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 119.293 0.951 . . . . 0.0 111.505 -177.491 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 77.8 mt -56.45 -53.71 37.25 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 123.523 0.729 . . . . 0.0 109.948 173.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -53.81 -49.29 58.9 Favored Glycine 0 CA--C 1.522 0.47 0 C-N-CA 124.443 1.021 . . . . 0.0 110.572 -179.124 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 7.3 mm -57.76 -44.53 86.1 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 C-N-CA 122.986 0.514 . . . . 0.0 110.185 176.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 39.6 t80 -55.81 -54.89 39.0 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 118.797 0.726 . . . . 0.0 109.89 175.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 37.4 m-70 -64.9 -26.78 68.46 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 113.48 0.918 . . . . 0.0 113.48 -177.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.2 ttmm -52.82 -26.11 13.53 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 118.694 0.679 . . . . 0.0 110.751 170.403 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -127.51 41.7 3.46 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.715 1.206 . . . . 0.0 109.118 173.174 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 31.9 m -38.27 103.18 0.03 OUTLIER 'General case' 0 C--N 1.348 0.512 0 C-N-CA 125.799 1.64 . . . . 0.0 112.408 -177.557 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -2.21 81.71 0.0 OUTLIER Glycine 0 C--N 1.34 0.775 0 C-N-CA 128.272 2.844 . . . . 0.0 114.646 177.503 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 44.2 mttp -73.68 -6.08 44.58 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 121.982 -0.716 . . . . 0.0 111.93 -169.226 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -77.41 52.28 0.94 Allowed 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.612 1.165 . . . . 0.0 109.713 176.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 70.31 -68.32 0.7 Allowed Glycine 0 CA--C 1.532 1.115 0 C-N-CA 124.316 0.96 . . . . 0.0 111.653 -174.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -79.65 113.36 17.74 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.892 0.877 . . . . 0.0 109.8 -177.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 40.4 mmtm -60.21 -16.76 36.21 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.926 1.29 . . . . 0.0 113.177 -177.141 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 21.4 t-160 -78.1 -12.39 59.99 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.742 0.817 . . . . 0.0 111.198 176.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 22.8 p -129.66 132.78 46.79 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 119.237 0.926 . . . . 0.0 113.256 -170.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -137.44 158.76 43.71 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.543 1.137 . . . . 0.0 110.77 176.824 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 88.8 p -117.71 -173.91 2.52 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.395 1.078 . . . . 0.0 112.8 -169.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 49.4 pttt -41.47 -54.53 3.09 Favored 'General case' 0 C--N 1.34 0.194 0 C-N-CA 126.144 1.778 . . . . 0.0 113.77 -177.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.84 -52.83 59.16 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 124.66 1.184 . . . . 0.0 108.457 -177.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -64.33 -38.59 91.57 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 123.723 0.809 . . . . 0.0 110.689 -177.441 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -60.95 -54.91 39.22 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 118.869 0.758 . . . . 0.0 111.299 175.245 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 53.4 mtmt -56.54 -48.53 77.06 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.067 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 62.9 tt0 -50.46 -59.0 4.45 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.174 0.989 . . . . 0.0 110.427 175.206 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mt -47.1 -65.87 0.5 Allowed 'General case' 0 C--O 1.232 0.165 0 C-N-CA 124.968 1.307 . . . . 0.0 110.411 177.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 16.7 tt -62.42 -45.7 98.17 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 C-N-CA 120.04 -0.664 . . . . 0.0 109.77 -170.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -58.72 -51.79 68.46 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 122.836 0.454 . . . . 0.0 111.404 -179.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -66.26 -57.66 7.06 Favored 'General case' 0 C--N 1.339 0.11 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 -177.517 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -71.96 -61.63 1.72 Allowed 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 -169.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 54.7 mt -88.82 63.5 6.86 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 5.3 t -72.82 48.72 0.21 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.376 1.07 . . . . 0.0 110.445 174.19 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 31.8 mt -78.5 83.0 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 N-CA-C 107.945 -1.132 . . . . 0.0 107.945 -174.23 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -46.98 -34.67 7.55 Favored Glycine 0 CA--C 1.534 1.228 0 C-N-CA 124.118 0.866 . . . . 0.0 112.209 172.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.1 m -59.04 -23.64 62.16 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.616 1.167 . . . . 0.0 113.807 176.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 34.9 mmtp 48.78 61.13 3.25 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 125.11 1.364 . . . . 0.0 111.175 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 84.4 mt -44.05 103.39 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.83 1.652 . . . . 0.0 113.325 -176.258 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 65.49 -76.64 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 126.505 1.922 . . . . 0.0 112.53 169.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -162.74 -40.01 0.04 OUTLIER 'General case' 0 C--O 1.226 -0.14 0 C-N-CA 124.65 1.18 . . . . 0.0 110.405 -171.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -38.03 -58.18 0.97 Allowed 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.648 1.179 . . . . 0.0 113.548 -171.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -64.21 -38.36 90.78 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 122.751 0.42 . . . . 0.0 111.196 -175.071 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -62.13 -54.12 38.61 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 N-CA-C 106.397 -1.705 . . . . 0.0 106.397 179.206 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 87.5 t -57.4 -42.09 79.88 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 C-N-CA 124.173 0.989 . . . . 0.0 110.566 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.05 -50.59 73.13 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 119.384 0.993 . . . . 0.0 110.886 175.13 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 42.1 mt -54.21 -45.19 72.18 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 119.396 -0.335 . . . . 0.0 110.681 177.168 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 23.2 mmt -64.94 -60.69 2.77 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 121.403 0.621 . . . . 0.0 109.499 177.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -42.7 -42.93 3.68 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 126.815 2.046 . . . . 0.0 111.521 -178.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -45.7 -45.37 14.22 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 118.517 -0.754 . . . . 0.0 112.97 178.19 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . 0.259 0.5 OUTLIER -72.04 -11.49 60.78 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 119.805 1.184 . . . . 0.0 113.209 -176.838 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -90.68 -53.89 4.22 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 118.983 0.81 . . . . 0.0 109.206 169.774 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 55.3 ttm-85 -55.23 -31.89 61.84 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.986 0.914 . . . . 0.0 110.693 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 70.4 m-80 -134.87 77.62 1.69 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 126.519 1.928 . . . . 0.0 109.244 175.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 43.0 mttp -70.63 -57.86 4.27 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 105.233 -2.136 . . . . 0.0 105.233 168.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -149.62 58.68 1.0 Allowed 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 126.886 2.074 . . . . 0.0 105.635 168.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -122.05 165.78 15.52 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 170.357 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.9 mp0 -115.89 132.51 56.62 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 106.241 -1.763 . . . . 0.0 106.241 169.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -96.96 151.16 4.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 C-N-CA 124.266 1.026 . . . . 0.0 108.467 172.442 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -92.94 177.12 6.18 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 122.834 0.454 . . . . 0.0 111.287 176.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 79.6 t80 -41.14 -62.43 0.84 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.315 1.046 . . . . 0.0 112.034 171.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 39.8 tp60 -60.64 -37.42 81.43 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 119.24 0.927 . . . . 0.0 111.623 -174.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -61.47 -44.68 96.67 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 119.28 0.946 . . . . 0.0 111.424 173.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -53.94 -50.03 67.38 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 118.742 0.701 . . . . 0.0 109.726 172.581 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.401 ' CG2' ' CG2' ' B' ' 74' ' ' ILE . 28.1 mm -57.96 -38.27 65.7 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 O-C-N 121.901 -0.499 . . . . 0.0 110.518 176.024 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 61.3 m -64.88 -42.39 94.85 Favored 'General case' 0 C--O 1.226 -0.134 0 CA-C-N 118.824 0.738 . . . . 0.0 110.234 177.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 33.0 t80 -55.55 -52.69 62.88 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.429 0.691 . . . . 0.0 109.213 174.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 62.3 mt -60.66 -44.69 96.14 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 177.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.13 -44.41 94.12 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 110.623 -0.991 . . . . 0.0 110.623 -176.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.85 -52.13 66.74 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.252 0.621 . . . . 0.0 109.824 174.718 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 11.7 tp -47.78 -58.15 4.7 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 122.002 0.906 . . . . 0.0 110.381 175.228 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -49.67 -55.47 13.65 Favored 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 125.43 1.492 . . . . 0.0 109.857 -179.327 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 12.9 ttp -60.53 -44.31 96.19 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 123.364 0.666 . . . . 0.0 111.507 -178.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 51.7 mt -59.19 -54.61 31.9 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-O 118.258 -0.877 . . . . 0.0 110.049 -178.36 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.391 0.6 OUTLIER -76.0 -34.22 59.71 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 118.188 -1.405 . . . . 0.0 112.964 -179.08 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 37.0 m-80 -80.33 71.06 7.11 Favored 'General case' 0 N--CA 1.465 0.276 0 O-C-N 120.654 -1.279 . . . . 0.0 108.747 170.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -46.55 -31.5 2.82 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.554 1.142 . . . . 0.0 112.798 -178.124 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -42.47 -37.75 1.71 Allowed 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.044 1.338 . . . . 0.0 113.729 173.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 88.4 mt -81.21 -13.65 58.34 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 112.949 0.722 . . . . 0.0 112.949 -177.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 48.0 mtpt -82.22 57.95 3.81 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 119.292 0.951 . . . . 0.0 110.392 -170.79 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.295 0 CA-C-O 118.209 -1.328 . . . . 0.0 113.021 -174.683 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 35.4 tpp . . . . . 0 N--CA 1.476 0.853 0 CA-C-O 121.776 0.798 . . . . 0.0 109.963 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -78.73 68.11 4.62 Favored 'General case' 0 N--CA 1.454 -0.249 0 O-C-N 121.852 -0.53 . . . . 0.0 109.764 178.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 9.6 m -54.14 160.57 2.31 Favored Pre-proline 0 CA--C 1.538 0.509 0 C-N-CA 123.309 0.643 . . . . 0.0 110.851 175.172 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_exo -42.16 -49.56 5.86 Favored 'Trans proline' 0 N--CA 1.459 -0.52 0 C-N-CA 123.775 2.983 . . . . 0.0 113.661 177.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 6.1 mt -54.52 -50.52 67.67 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-N 117.956 0.344 . . . . 0.0 111.54 173.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -63.49 -40.9 98.31 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 118.211 0.459 . . . . 0.0 110.196 -175.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 tp60 -61.89 -47.07 86.64 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 122.142 0.177 . . . . 0.0 110.694 174.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.05 -46.88 85.45 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.465 0.706 . . . . 0.0 111.02 -178.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 62.1 mt -51.4 -54.4 11.91 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 N-CA-C 107.948 -1.131 . . . . 0.0 107.948 169.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.07 -46.88 20.57 Favored Glycine 0 CA--C 1.528 0.859 0 C-N-CA 124.906 1.241 . . . . 0.0 112.183 175.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.2 mt -57.38 -54.21 49.37 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 117.59 0.695 . . . . 0.0 111.055 174.489 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -58.52 -44.07 89.37 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 118.863 0.756 . . . . 0.0 111.481 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 72.2 mt -54.38 -55.73 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 C-N-CA 123.462 0.705 . . . . 0.0 110.077 172.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.28 -51.38 51.36 Favored Glycine 0 CA--C 1.524 0.633 0 N-CA-C 110.234 -1.146 . . . . 0.0 110.234 -176.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 14.1 mm -54.5 -45.83 70.84 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 C-N-CA 122.79 0.436 . . . . 0.0 110.499 175.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -57.12 -60.19 3.98 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 118.465 0.575 . . . . 0.0 109.997 176.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -55.34 -36.46 66.31 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 124.424 1.09 . . . . 0.0 111.511 -174.181 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -52.59 -31.06 34.4 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.566 1.146 . . . . 0.0 112.257 176.714 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -112.59 -34.08 5.94 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.764 0.711 . . . . 0.0 112.076 -179.315 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 77.8 p -74.42 -35.54 63.4 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 119.135 0.88 . . . . 0.0 110.866 179.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -72.45 61.76 1.5 Allowed Glycine 0 C--N 1.341 0.815 0 C-N-CA 125.181 1.372 . . . . 0.0 111.032 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -144.45 -53.28 0.32 Allowed 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 127.22 2.208 . . . . 0.0 106.715 -177.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -78.22 164.83 24.58 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 169.328 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -61.26 -54.31 37.38 Favored Glycine 0 CA--C 1.528 0.885 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 177.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -79.45 67.74 5.28 Favored 'General case' 0 CA--C 1.531 0.217 0 O-C-N 122.124 -0.633 . . . . 0.0 109.776 -177.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -68.79 5.2 1.16 Allowed 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 114.262 1.208 . . . . 0.0 114.262 -176.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -78.34 -11.54 59.95 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 166.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 22.9 p -129.87 164.25 24.56 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 124.836 1.255 . . . . 0.0 111.419 -177.755 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -159.56 169.07 24.62 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.626 1.17 . . . . 0.0 109.364 169.716 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 78.5 p -115.94 174.16 6.18 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 -169.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 38.1 mtmm -26.35 -60.3 0.08 Allowed 'General case' 0 C--N 1.34 0.171 0 C-N-CA 127.764 2.426 . . . . 0.0 112.597 169.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 28.8 ttpp -53.37 -53.23 54.18 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.885 0.874 . . . . 0.0 110.748 -177.091 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -61.36 -40.44 94.31 Favored 'General case' 0 C--O 1.222 -0.344 0 CA-C-O 118.967 -0.54 . . . . 0.0 110.595 179.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 31.1 mt -64.49 -48.05 76.65 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.934 0.788 . . . . 0.0 111.179 -179.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -58.12 -47.93 81.77 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 176.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.63 -51.14 69.85 Favored 'General case' 0 C--O 1.225 -0.216 0 CA-C-N 117.762 0.255 . . . . 0.0 111.242 174.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 11.5 mt -48.18 -57.51 5.8 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 124.25 1.02 . . . . 0.0 109.77 179.07 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 1.3 mp -56.84 -59.1 3.42 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 C-N-CA 120.18 -0.608 . . . . 0.0 109.831 175.179 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -51.33 -46.8 62.75 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.358 0.663 . . . . 0.0 112.372 -171.183 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.71 -64.54 1.16 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.709 0.804 . . . . 0.0 110.08 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -73.87 -24.84 59.8 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -167.177 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 96.3 mt -124.24 64.89 1.07 Allowed 'General case' 0 C--N 1.333 -0.12 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 169.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 5.1 t -69.24 53.3 0.1 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.176 1.391 . . . . 0.0 111.123 173.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 63.0 mt -78.68 76.74 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.659 0 N-CA-C 106.707 -1.59 . . . . 0.0 106.707 -178.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -48.49 -50.46 24.33 Favored Glycine 0 CA--C 1.529 0.95 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 176.047 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 6.4 m -70.96 67.43 0.41 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.282 1.033 . . . . 0.0 110.214 170.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 27.0 mmtm -44.48 92.86 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 126.78 2.032 . . . . 0.0 112.306 -174.607 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 98.2 mt -58.47 112.85 1.73 Allowed 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 124.131 0.972 . . . . 0.0 112.51 -172.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 63.94 -79.2 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 125.387 1.475 . . . . 0.0 113.773 167.066 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -169.76 -41.65 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 118.279 0.491 . . . . 0.0 111.927 -167.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -34.77 -60.99 0.42 Allowed 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.905 1.282 . . . . 0.0 113.72 -176.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -66.23 -33.97 76.96 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.588 0.355 . . . . 0.0 111.365 -174.469 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -62.89 -55.73 21.87 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 178.665 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 55.8 t -57.66 -43.82 84.3 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 CA-C-O 118.755 -0.64 . . . . 0.0 110.599 179.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.48 -51.06 69.87 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 119.233 0.924 . . . . 0.0 110.562 176.492 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 55.2 mt -56.63 -40.58 75.63 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 119.058 -0.496 . . . . 0.0 111.405 178.751 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 28.3 mmt -67.25 -65.04 0.74 Allowed 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.919 0.781 . . . . 0.0 109.453 175.531 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -40.58 -41.93 1.57 Allowed 'General case' 0 CA--C 1.521 -0.155 0 C-N-CA 128.022 2.529 . . . . 0.0 111.939 -177.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -37.73 -49.17 1.13 Allowed 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 124.93 1.292 . . . . 0.0 112.287 176.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.6 pp -61.18 -42.91 99.41 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 120.958 -0.297 . . . . 0.0 111.085 -176.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -73.98 -38.3 64.19 Favored 'General case' 0 C--O 1.226 -0.173 0 C-N-CA 123.155 0.582 . . . . 0.0 110.407 -179.175 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 15.8 ttm180 -59.46 -47.98 83.39 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.164 0.586 . . . . 0.0 109.951 177.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -79.71 -48.8 13.06 Favored 'General case' 0 N--CA 1.457 -0.094 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.264 -175.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 54.5 mttp 57.64 -97.37 0.07 Allowed 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 -166.503 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -135.47 34.26 2.99 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.871 0.868 . . . . 0.0 110.03 172.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -123.61 143.69 50.07 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 124.581 1.152 . . . . 0.0 109.027 176.405 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 40.6 mp0 -71.59 135.87 47.16 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 171.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 11.7 m -80.07 145.25 9.46 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 171.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -82.89 172.21 13.06 Favored 'General case' 0 CA--C 1.528 0.107 0 CA-C-N 117.961 0.346 . . . . 0.0 111.193 176.282 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -40.86 -61.61 0.94 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.185 0.994 . . . . 0.0 112.146 172.161 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 38.2 tp60 -60.33 -37.04 79.36 Favored 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.224 -0.922 . . . . 0.0 111.795 -175.692 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -64.93 -40.82 95.62 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 121.284 -0.885 . . . . 0.0 111.488 174.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -56.43 -49.72 73.74 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.571 -0.706 . . . . 0.0 109.622 170.535 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.401 ' CG2' ' CG2' ' A' ' 74' ' ' ILE . 29.0 mm -56.24 -39.56 60.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 175.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 43.1 m -65.69 -35.74 81.63 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 118.59 0.632 . . . . 0.0 110.679 176.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 13.1 t80 -56.02 -56.25 23.06 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 171.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 67.7 mt -61.25 -40.13 92.91 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 179.089 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -69.05 -45.6 61.92 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 110.675 -0.97 . . . . 0.0 110.675 -176.134 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.29 -43.82 89.92 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 122.112 -0.64 . . . . 0.0 110.058 175.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 12.0 tp -50.56 -57.58 7.82 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-O 121.371 0.605 . . . . 0.0 109.939 172.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.19 -50.86 48.04 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 124.441 1.096 . . . . 0.0 110.527 176.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 49.2 ttm -58.33 -47.75 82.74 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.715 0.806 . . . . 0.0 111.135 -178.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 93.9 mt -64.65 -52.72 51.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 CA-C-O 118.135 -0.936 . . . . 0.0 110.398 -176.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.449 0.1 OUTLIER -76.2 -38.86 55.96 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 118.521 -1.271 . . . . 0.0 113.3 -176.672 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -82.13 66.99 7.96 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 169.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -39.44 -37.8 0.5 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.818 1.647 . . . . 0.0 113.842 -175.188 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.99 -53.98 0.47 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.004 1.722 . . . . 0.0 112.502 169.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 93.2 mt -63.25 -14.41 49.07 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 123.81 0.844 . . . . 0.0 113.081 -174.039 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -64.89 -33.28 75.65 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 119.894 1.225 . . . . 0.0 110.391 172.276 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.125 0 CA-C-O 117.318 -1.823 . . . . 0.0 110.622 -175.818 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 72.7 mtp . . . . . 0 N--CA 1.474 0.741 0 N-CA-C 109.824 -0.435 . . . . 0.0 109.824 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.85 67.36 3.7 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 171.192 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.1 m -55.56 163.09 2.04 Favored Pre-proline 0 CA--C 1.537 0.452 0 C-N-CA 124.102 0.961 . . . . 0.0 110.846 178.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -43.85 -49.02 8.57 Favored 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 123.62 2.88 . . . . 0.0 113.409 179.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.2 mt -55.14 -52.13 64.25 Favored 'General case' 0 C--O 1.225 -0.218 0 O-C-N 122.369 -0.207 . . . . 0.0 111.512 174.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -61.56 -41.98 98.18 Favored 'General case' 0 C--O 1.226 -0.181 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 -175.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 12.6 tp-100 -60.31 -51.25 70.33 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 123.4 0.68 . . . . 0.0 110.203 177.157 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.14 -46.15 88.58 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.291 0.636 . . . . 0.0 111.442 -177.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 56.4 mt -53.07 -51.43 38.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 170.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -48.61 -48.03 29.18 Favored Glycine 0 CA--C 1.525 0.688 0 C-N-CA 125.14 1.352 . . . . 0.0 111.587 175.649 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 mt -56.54 -54.03 50.6 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 117.652 0.726 . . . . 0.0 111.055 174.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 mp -58.81 -43.71 90.64 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 119.032 0.833 . . . . 0.0 111.453 -179.404 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 94.2 mt -56.52 -51.66 62.58 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 C-N-CA 123.632 0.773 . . . . 0.0 110.36 172.641 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.23 -51.58 53.19 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.046 -1.222 . . . . 0.0 110.046 -178.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 10.4 mm -57.01 -46.29 84.08 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 123.158 0.583 . . . . 0.0 110.284 176.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 40.6 t80 -53.2 -59.16 4.9 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 121.211 0.529 . . . . 0.0 109.965 176.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 67.4 t60 -62.09 -33.75 75.02 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.706 -175.682 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -51.96 -45.61 64.46 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.69 0.677 . . . . 0.0 110.963 176.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -89.86 -49.55 6.56 Favored 'General case' 0 N--CA 1.46 0.037 0 CA-C-O 118.932 -0.556 . . . . 0.0 110.946 -178.67 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 74.8 m -49.55 -36.33 23.29 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-N 119.166 0.894 . . . . 0.0 111.384 174.652 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -30.75 -42.66 0.07 OUTLIER Glycine 0 CA--C 1.527 0.785 0 C-N-CA 127.369 2.414 . . . . 0.0 114.691 172.555 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 14.3 ptpt -80.73 -15.67 55.89 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 -173.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -101.51 126.4 48.31 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 125.052 1.341 . . . . 0.0 107.506 177.604 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -41.88 -38.66 2.5 Favored Glycine 0 CA--C 1.535 1.32 0 C-N-CA 124.562 1.077 . . . . 0.0 113.945 -175.706 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -77.58 69.17 3.79 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.508 1.123 . . . . 0.0 108.728 170.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 48.0 mtmt -72.18 31.95 0.06 Allowed 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 116.038 1.866 . . . . 0.0 116.038 -168.056 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 4.7 p80 -150.36 43.95 0.86 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.884 1.274 . . . . 0.0 109.149 168.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -161.25 155.12 22.23 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 103.192 -2.892 . . . . 0.0 103.192 178.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -160.74 168.04 25.62 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 120.158 1.345 . . . . 0.0 112.253 177.555 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 24.7 p -113.19 176.46 5.01 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.617 0.723 . . . . 0.0 112.503 -173.42 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 20.7 pttm -40.62 -46.94 2.66 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 126.051 1.74 . . . . 0.0 112.846 174.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.0 tmmt? -59.08 -49.7 76.89 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -178.083 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 27.2 mp0 -62.98 -38.62 91.88 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 118.756 -0.64 . . . . 0.0 110.963 177.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 26.1 mt -62.43 -45.01 95.05 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 119.319 0.963 . . . . 0.0 111.182 178.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -58.3 -49.47 77.03 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 122.025 -0.422 . . . . 0.0 109.978 173.203 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 57.6 mt-10 -56.47 -43.82 79.97 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 118.03 0.377 . . . . 0.0 111.449 175.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.0 mt -54.32 -56.3 19.84 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 119.296 0.953 . . . . 0.0 109.492 -178.432 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 1.3 mp -55.96 -60.7 1.55 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 175.409 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.8 tt0 -52.31 -51.42 58.74 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.649 0.78 . . . . 0.0 112.383 -171.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.1 mmpt? -73.4 -61.12 1.94 Allowed 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.987 1.315 . . . . 0.0 109.307 -175.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 60.5 mm-40 -76.71 -58.01 3.53 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -169.896 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 85.1 mt -87.01 61.86 7.04 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 178.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.5 t -73.12 56.56 0.45 Allowed 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.704 1.202 . . . . 0.0 109.712 173.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 72.2 mt -68.39 -45.83 81.67 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 C-N-CA 125.764 1.626 . . . . 0.0 109.057 -175.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.59 -68.83 1.21 Allowed Glycine 0 CA--C 1.528 0.864 0 N-CA-C 110.522 -1.031 . . . . 0.0 110.522 -178.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.8 m -71.28 71.14 0.61 Allowed 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.286 1.034 . . . . 0.0 109.292 170.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 60.8 mmtt -46.8 95.45 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.918 1.687 . . . . 0.0 111.18 -175.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 73.5 mt -35.89 -54.62 0.75 Allowed 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 126.581 1.952 . . . . 0.0 113.495 -171.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -163.2 161.97 25.2 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 -174.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -35.47 -41.01 0.17 Allowed 'General case' 0 N--CA 1.462 0.153 0 C-N-CA 128.226 2.61 . . . . 0.0 114.513 -172.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.46 -58.27 0.16 Allowed 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 126.08 1.752 . . . . 0.0 113.839 -177.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -70.08 -35.88 74.51 Favored 'General case' 0 CA--C 1.53 0.191 0 O-C-N 122.258 -0.276 . . . . 0.0 111.466 -173.23 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 1.2 mp -62.72 -54.71 30.27 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 177.064 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 72.5 t -54.21 -44.45 64.67 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 C-N-CA 124.458 1.103 . . . . 0.0 110.034 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 2.9 mptp? -57.52 -53.17 61.23 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 118.283 0.492 . . . . 0.0 110.793 175.337 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 71.2 mt -54.83 -37.81 66.61 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 118.965 -0.54 . . . . 0.0 111.198 178.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 27.8 mmt -66.95 -67.61 0.44 Allowed 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 118.809 0.732 . . . . 0.0 109.525 173.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -40.48 -42.62 1.66 Allowed 'General case' 0 C--N 1.341 0.199 0 C-N-CA 127.527 2.331 . . . . 0.0 111.95 -176.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -38.7 -49.64 1.59 Allowed 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 125.261 1.424 . . . . 0.0 112.492 177.095 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -63.24 -42.0 99.14 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 121.032 -0.267 . . . . 0.0 110.715 -176.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -69.52 -42.17 75.04 Favored 'General case' 0 N--CA 1.457 -0.084 0 C-N-CA 123.538 0.735 . . . . 0.0 109.602 -178.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 17.5 ttm180 -58.17 -51.45 69.7 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 124.25 1.02 . . . . 0.0 110.143 178.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -82.47 -46.57 13.28 Favored 'General case' 0 CA--C 1.522 -0.099 0 N-CA-C 111.597 0.221 . . . . 0.0 111.597 -172.051 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 56.8 mttp 59.35 -87.58 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.49 1.116 . . . . 0.0 108.866 -168.135 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 25.8 m-20 -148.35 38.01 0.86 Allowed 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.996 1.319 . . . . 0.0 109.644 171.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -126.26 145.95 50.2 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 125.179 1.392 . . . . 0.0 107.739 175.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 22.5 mp0 -67.05 164.75 17.16 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 169.286 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 25.8 m -115.05 149.11 17.36 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.558 0 C-N-CA 125.917 1.687 . . . . 0.0 107.758 169.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -85.8 175.57 8.6 Favored 'General case' 0 C--N 1.338 0.102 0 C-N-CA 123.68 0.792 . . . . 0.0 111.015 177.454 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -41.91 -63.8 0.68 Allowed 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.806 1.242 . . . . 0.0 112.436 175.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 9.9 tp-100 -64.5 -30.45 71.48 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 120.339 1.427 . . . . 0.0 112.019 -173.276 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -66.84 -45.53 77.94 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 119.35 0.977 . . . . 0.0 110.348 175.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -54.72 -52.27 62.99 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 172.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 22.8 mm -55.32 -41.41 61.58 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.411 0 C-N-CA 123.102 0.561 . . . . 0.0 109.519 176.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 99.4 m -62.39 -36.04 81.08 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-N 119.089 0.859 . . . . 0.0 111.062 177.088 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -54.89 -54.57 40.8 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 118.887 0.767 . . . . 0.0 109.185 171.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 62.3 mt -63.63 -40.86 97.97 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 -179.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -72.83 -44.29 38.58 Favored Glycine 0 CA--C 1.522 0.522 0 N-CA-C 110.128 -1.189 . . . . 0.0 110.128 -174.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.43 -45.11 92.44 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 121.949 -0.736 . . . . 0.0 109.795 173.255 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 12.4 tp -49.81 -58.14 5.96 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 118.802 0.728 . . . . 0.0 109.909 173.133 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -49.34 -54.03 19.19 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 124.804 1.242 . . . . 0.0 110.606 178.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 25.4 ttp -64.11 -41.54 97.21 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.252 0.621 . . . . 0.0 112.068 -176.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 80.0 mt -65.12 -51.56 64.29 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 CA-C-O 118.042 -0.98 . . . . 0.0 109.746 -178.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.46 0.1 OUTLIER -75.76 -39.3 57.34 Favored 'General case' 0 C--N 1.346 0.436 0 CA-C-N 119.713 1.142 . . . . 0.0 113.283 -178.544 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 -81.07 65.01 6.05 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 168.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -47.91 -32.86 6.8 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.94 1.296 . . . . 0.0 112.4 -169.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -32.54 -50.55 0.25 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 126.104 1.762 . . . . 0.0 112.773 168.355 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 63.2 mt -61.53 -20.08 62.84 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.015 0.926 . . . . 0.0 113.322 -174.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -65.82 -26.22 67.57 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 119.512 1.051 . . . . 0.0 110.999 173.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.185 0 CA-C-O 117.279 -1.845 . . . . 0.0 111.498 -176.516 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 92.5 mmm . . . . . 0 N--CA 1.476 0.835 0 N-CA-C 110.491 -0.189 . . . . 0.0 110.491 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -79.25 63.83 3.99 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 121.191 0.519 . . . . 0.0 110.053 177.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 4.2 m -58.1 165.17 2.84 Favored Pre-proline 0 CA--C 1.538 0.513 0 C-N-CA 124.961 1.305 . . . . 0.0 111.365 179.193 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -44.47 -46.77 11.71 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 123.503 2.802 . . . . 0.0 113.306 177.834 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.7 mt -56.16 -51.48 67.82 Favored 'General case' 0 C--O 1.225 -0.229 0 CA-C-N 117.844 0.293 . . . . 0.0 111.577 174.123 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -57.83 -45.57 85.97 Favored 'General case' 0 N--CA 1.456 -0.159 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 -177.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -58.73 -51.57 69.41 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 122.932 0.493 . . . . 0.0 110.727 177.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.32 -45.41 88.0 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.719 0.807 . . . . 0.0 111.668 -176.158 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 78.7 mt -54.13 -52.38 38.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 170.475 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.15 -48.36 15.08 Favored Glycine 0 CA--C 1.528 0.855 0 C-N-CA 124.867 1.222 . . . . 0.0 111.946 174.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.3 mt -56.88 -55.85 29.15 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 117.649 0.725 . . . . 0.0 111.27 174.407 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -58.69 -42.38 88.42 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.172 0.897 . . . . 0.0 111.711 -178.445 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 78.7 mt -54.63 -58.97 2.64 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.135 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 171.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -52.29 -48.03 54.69 Favored Glycine 0 CA--C 1.524 0.604 0 C-N-CA 124.726 1.155 . . . . 0.0 111.214 -175.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 12.5 mm -54.63 -46.58 72.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 C-N-CA 123.105 0.562 . . . . 0.0 110.386 176.395 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 26.2 t80 -61.05 -54.27 46.88 Favored 'General case' 0 CA--C 1.531 0.241 0 O-C-N 121.708 -0.62 . . . . 0.0 109.818 176.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -50.74 -41.72 56.81 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 125.308 1.443 . . . . 0.0 111.435 -176.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -55.58 -34.01 64.41 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.934 1.293 . . . . 0.0 112.407 179.312 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 47.1 m-85 -109.06 -57.45 2.15 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 123.587 0.755 . . . . 0.0 110.896 -176.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -73.93 -48.71 28.71 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.504 0.722 . . . . 0.0 110.244 -177.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.45 64.19 3.25 Favored Glycine 0 C--N 1.336 0.541 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.681 -168.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 20.4 mmmt -106.06 -166.27 1.18 Allowed 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 169.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -78.65 65.7 3.97 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.149 0.58 . . . . 0.0 109.742 -179.446 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -165.63 -145.37 4.4 Favored Glycine 0 CA--C 1.527 0.828 0 N-CA-C 110.32 -1.112 . . . . 0.0 110.32 -177.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -78.75 62.63 3.31 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.591 1.156 . . . . 0.0 110.568 -174.118 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.79 -20.97 2.46 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 116.475 2.028 . . . . 0.0 116.475 -169.497 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 21.9 t-160 -78.51 -19.57 52.68 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.493 1.117 . . . . 0.0 111.552 179.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 1.1 p -130.57 158.68 39.33 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 125.107 1.363 . . . . 0.0 112.606 -168.452 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.94 -179.79 7.84 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.055 1.342 . . . . 0.0 108.553 169.423 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 7.3 t -141.6 -163.21 1.52 Allowed 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 119.355 0.98 . . . . 0.0 112.673 -178.127 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 8.6 mtpm? -36.79 -69.12 0.12 Allowed 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 128.716 2.806 . . . . 0.0 113.662 -169.189 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -55.38 -46.97 76.5 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 122.772 0.429 . . . . 0.0 110.068 -173.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -61.32 -44.12 97.74 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 123.797 0.839 . . . . 0.0 110.712 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 51.7 mt -61.31 -52.98 62.43 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 118.341 0.519 . . . . 0.0 111.015 177.072 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 47.9 mtpt -60.92 -42.61 98.46 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -177.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 66.4 mt-10 -54.61 -55.58 28.02 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-O 118.962 -0.542 . . . . 0.0 110.904 169.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 9.1 mt -47.36 -58.89 3.63 Favored 'General case' 0 N--CA 1.457 -0.103 0 C-N-CA 123.406 0.682 . . . . 0.0 110.193 -178.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 13.3 tt -59.34 -55.18 25.39 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 C-N-CA 119.766 -0.774 . . . . 0.0 110.54 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -58.41 -46.05 87.18 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 118.435 0.562 . . . . 0.0 112.438 -172.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -76.76 -51.08 12.07 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.509 0.724 . . . . 0.0 110.093 -177.263 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -83.54 -28.7 28.43 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -168.247 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 32.7 mt -96.27 86.96 4.35 Favored 'General case' 0 C--N 1.338 0.069 0 N-CA-C 106.412 -1.699 . . . . 0.0 106.412 168.483 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 72.3 p -77.3 56.65 1.36 Allowed 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 124.848 1.259 . . . . 0.0 109.063 -178.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 36.3 mt -75.02 -58.84 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.605 0 C-N-CA 124.395 1.078 . . . . 0.0 108.426 -174.282 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 68.61 -71.68 0.37 Allowed Glycine 0 CA--C 1.529 0.942 0 N-CA-C 110.092 -1.203 . . . . 0.0 110.092 -174.655 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 19.3 m -63.6 80.27 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 125.629 1.572 . . . . 0.0 110.146 172.404 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 11.6 mmtm -39.96 91.52 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 127.358 2.263 . . . . 0.0 112.2 178.096 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 89.3 mt -52.68 -54.15 37.42 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 124.569 1.148 . . . . 0.0 111.921 -173.105 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -164.77 160.61 19.84 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 -174.468 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -38.12 -42.06 0.63 Allowed 'General case' 0 C--O 1.227 -0.113 0 C-N-CA 127.474 2.31 . . . . 0.0 114.397 -171.474 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.58 -61.57 0.14 Allowed 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 125.594 1.558 . . . . 0.0 114.146 -175.217 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -60.31 -43.15 96.62 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.298 0.639 . . . . 0.0 111.333 -175.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -62.16 -51.99 65.79 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 N-CA-C 106.066 -1.827 . . . . 0.0 106.066 -178.785 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 70.7 t -55.3 -40.02 54.74 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.613 0 CA-C-N 114.891 -1.05 . . . . 0.0 110.239 178.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.84 -52.81 63.48 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 120.214 1.37 . . . . 0.0 110.517 174.741 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 57.1 mt -53.52 -39.57 64.74 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 119.573 -0.251 . . . . 0.0 110.683 -178.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 22.9 mmt -71.12 -64.23 0.95 Allowed 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.424 0.63 . . . . 0.0 110.003 175.54 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.01 -29.4 60.29 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 125.041 1.336 . . . . 0.0 112.212 -169.718 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -39.52 -50.69 2.19 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 124.632 1.173 . . . . 0.0 111.037 170.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 54.1 mt -58.82 -47.08 86.07 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.125 -176.421 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -69.73 -46.43 65.93 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.439 0.696 . . . . 0.0 111.283 -178.128 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 50.9 ttt85 -56.84 -52.22 65.94 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 124.972 1.309 . . . . 0.0 109.414 -179.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -78.87 -56.8 4.12 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 116.625 -0.261 . . . . 0.0 111.556 -176.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 45.1 mttm 64.82 -78.01 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.738 1.215 . . . . 0.0 109.041 -167.531 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -147.57 20.54 1.18 Allowed 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 125.572 1.549 . . . . 0.0 110.49 171.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -97.19 144.34 27.11 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 124.188 0.995 . . . . 0.0 108.82 -177.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -82.12 142.25 32.41 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 167.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 20.9 m -99.89 146.49 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 169.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -85.36 176.02 8.54 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 123.418 0.687 . . . . 0.0 111.271 175.885 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -40.65 -63.82 0.6 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.306 1.043 . . . . 0.0 112.533 172.421 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 61.6 tp60 -61.03 -36.21 78.92 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 119.755 1.161 . . . . 0.0 111.671 -175.425 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -64.37 -35.84 82.18 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.255 -0.903 . . . . 0.0 111.081 175.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -62.97 -46.8 86.02 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.507 -0.746 . . . . 0.0 109.626 169.361 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 24.2 mm -60.63 -29.19 44.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 O-C-N 121.49 -0.756 . . . . 0.0 110.513 176.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 25.3 m -67.2 -45.13 77.8 Favored 'General case' 0 C--O 1.227 -0.1 0 O-C-N 121.232 -0.917 . . . . 0.0 109.411 171.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -52.32 -54.99 24.51 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 173.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 38.8 mt -59.44 -46.36 88.98 Favored 'General case' 0 CA--C 1.529 0.168 0 O-C-N 121.727 -0.608 . . . . 0.0 111.691 177.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.57 -45.68 92.91 Favored Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 -179.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.97 -51.74 65.71 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 123.493 0.717 . . . . 0.0 110.023 177.281 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -47.36 -58.68 3.87 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.95 0.881 . . . . 0.0 110.272 174.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.08 -56.61 11.73 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 125.18 1.392 . . . . 0.0 110.643 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 12.8 ttp -67.05 -39.15 86.84 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.607 0.763 . . . . 0.0 111.806 -174.372 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 64.5 mt -63.74 -51.76 65.75 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 CA-C-O 117.807 -1.092 . . . . 0.0 109.195 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.474 0.3 OUTLIER -75.25 -38.15 60.67 Favored 'General case' 0 C--N 1.348 0.5 0 CA-C-N 119.897 1.226 . . . . 0.0 113.319 -179.867 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 -80.57 61.88 4.44 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 168.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -52.26 -25.01 8.31 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.532 1.133 . . . . 0.0 112.55 -175.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -38.6 -46.72 1.23 Allowed 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.164 1.385 . . . . 0.0 111.845 167.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 84.4 mt -66.85 -25.03 66.23 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.12 0.968 . . . . 0.0 113.041 -178.218 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt -80.15 -44.42 19.91 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 171.146 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.13 0 CA-C-O 117.427 -1.763 . . . . 0.0 110.386 174.116 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 ppp? . . . . . 0 N--CA 1.477 0.903 0 N-CA-C 113.072 0.767 . . . . 0.0 113.072 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -71.83 80.7 0.88 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.99 0.916 . . . . 0.0 111.431 -173.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 78.7 p -60.69 167.4 3.4 Favored Pre-proline 0 CA--C 1.536 0.418 0 C-N-CA 124.414 1.086 . . . . 0.0 112.2 175.479 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -50.57 -44.3 40.84 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 122.619 2.213 . . . . 0.0 111.215 168.245 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.8 mt -53.65 -57.49 10.61 Favored 'General case' 0 C--N 1.342 0.252 0 CA-C-O 119.448 -0.31 . . . . 0.0 111.671 170.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -52.57 -47.65 66.68 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 120.848 0.356 . . . . 0.0 110.356 -177.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 -59.39 -49.41 77.92 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.921 0.888 . . . . 0.0 110.919 178.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.77 -46.63 88.74 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.866 0.866 . . . . 0.0 111.132 -178.084 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 83.1 mt -54.67 -51.41 51.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 172.057 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.72 -50.35 14.78 Favored Glycine 0 CA--C 1.53 0.991 0 C-N-CA 124.562 1.077 . . . . 0.0 111.963 173.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 mt -54.65 -54.37 42.52 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 117.721 0.761 . . . . 0.0 110.936 175.297 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 9.8 mp -58.71 -43.68 90.17 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 118.79 0.723 . . . . 0.0 111.687 -178.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 97.3 mt -58.59 -52.18 62.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 C-N-CA 123.22 0.608 . . . . 0.0 110.433 174.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.96 -54.55 34.51 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 109.942 -1.263 . . . . 0.0 109.942 -178.325 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 6.0 mm -50.01 -50.11 20.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.25 0 C-N-CA 123.843 0.857 . . . . 0.0 109.911 174.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -52.89 -62.71 1.47 Allowed 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 179.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -63.38 -23.57 67.47 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 -175.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.8 ttpp -53.94 -24.69 17.28 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 118.782 0.719 . . . . 0.0 111.97 170.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -116.95 -37.34 3.61 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.044 0.938 . . . . 0.0 112.792 175.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 75.5 p -79.82 -32.01 40.64 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 119.515 1.052 . . . . 0.0 112.164 -178.169 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.1 61.77 3.4 Favored Glycine 0 CA--C 1.527 0.802 0 C-N-CA 124.249 0.928 . . . . 0.0 112.088 -169.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 33.1 mtmm -98.21 -82.92 0.42 Allowed 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 124.552 1.141 . . . . 0.0 109.571 -176.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -148.65 159.99 43.57 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.704 1.201 . . . . 0.0 108.057 -177.3 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 54.49 -107.43 0.68 Allowed Glycine 0 CA--C 1.529 0.918 0 C-N-CA 123.931 0.777 . . . . 0.0 112.301 174.072 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 40.9 t0 -79.82 61.93 3.9 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 121.876 0.846 . . . . 0.0 110.25 -174.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 6.0 mtmp? -59.96 -16.73 32.47 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.064 1.346 . . . . 0.0 113.454 -172.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 6.5 p-80 -89.46 9.71 25.41 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 175.36 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 74.6 p -123.06 164.63 18.23 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 118.828 0.74 . . . . 0.0 111.318 174.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -159.69 -165.04 1.44 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.211 1.404 . . . . 0.0 107.44 169.498 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 9.2 m -156.88 -179.5 8.26 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 119.371 0.987 . . . . 0.0 111.633 -171.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -19.72 -72.98 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 129.247 3.019 . . . . 0.0 114.429 176.78 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 39.8 ttpt -53.42 -52.16 60.27 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.515 1.126 . . . . 0.0 109.785 -175.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -58.86 -42.84 90.33 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 118.725 -0.655 . . . . 0.0 111.124 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 13.4 mt -61.55 -50.03 74.3 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 119.141 0.882 . . . . 0.0 111.459 176.486 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 62.0 mtpt -58.55 -46.41 86.92 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 122.191 -0.318 . . . . 0.0 110.221 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.81 -51.88 67.24 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 122.856 0.463 . . . . 0.0 110.998 173.773 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.0 mt -46.53 -61.1 1.97 Allowed 'General case' 0 C--N 1.333 -0.151 0 C-N-CA 123.747 0.819 . . . . 0.0 110.561 177.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 16.8 tt -59.41 -52.24 63.23 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 C-N-CA 119.829 -0.748 . . . . 0.0 110.157 -178.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -53.99 -50.35 66.79 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 123.604 0.761 . . . . 0.0 112.456 -175.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.06 -53.04 7.86 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 123.629 0.771 . . . . 0.0 110.266 -176.77 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 49.2 mm-40 -81.16 -24.38 37.6 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -167.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 47.4 mt -105.94 84.01 2.0 Allowed 'General case' 0 CA--C 1.527 0.074 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 169.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 52.6 p -75.2 57.41 0.86 Allowed 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 125.479 1.512 . . . . 0.0 109.109 178.174 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 30.0 mt -73.25 -51.75 24.64 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.62 0 C-N-CA 124.073 0.949 . . . . 0.0 108.619 -175.31 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 71.61 -67.72 1.0 Allowed Glycine 0 CA--C 1.528 0.876 0 N-CA-C 110.408 -1.077 . . . . 0.0 110.408 -176.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 19.8 m -69.24 74.42 0.34 Allowed 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 125.191 1.397 . . . . 0.0 110.227 174.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -32.85 90.94 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 128.011 2.524 . . . . 0.0 112.785 -179.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 83.8 mt -65.35 112.43 3.5 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 123.93 0.892 . . . . 0.0 112.34 -169.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 63.48 -77.4 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.553 1.541 . . . . 0.0 113.292 167.16 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -166.58 -46.61 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 123.921 0.888 . . . . 0.0 110.194 -169.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -36.4 -62.98 0.42 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.966 1.306 . . . . 0.0 113.415 -175.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 73.1 tt0 -59.35 -43.05 92.86 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.85 0.86 . . . . 0.0 111.004 -178.605 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -60.89 -53.72 45.24 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 N-CA-C 106.49 -1.67 . . . . 0.0 106.49 -173.834 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 66.6 t -56.01 -58.68 4.24 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 CA-C-O 118.154 -0.927 . . . . 0.0 108.647 176.256 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -41.22 -51.52 3.51 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 119.038 0.835 . . . . 0.0 112.403 -178.738 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 27.0 mt -55.92 -43.78 77.66 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -176.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 1.4 mpp? -82.07 -58.34 3.01 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.958 0.903 . . . . 0.0 109.997 -179.585 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -42.78 -31.29 0.46 Allowed 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 126.671 1.988 . . . . 0.0 111.954 176.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -37.2 -43.44 0.51 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.587 1.155 . . . . 0.0 113.261 172.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -58.02 -57.58 12.2 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.51 -0.744 . . . . 0.0 110.115 177.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -58.61 -45.41 89.25 Favored 'General case' 0 C--O 1.224 -0.289 0 C-N-CA 124.381 1.073 . . . . 0.0 110.361 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 43.0 tpt85 -50.13 -46.0 53.51 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 126.074 1.75 . . . . 0.0 110.785 177.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -78.1 -32.93 50.85 Favored 'General case' 0 C--O 1.226 -0.172 0 O-C-N 123.508 0.505 . . . . 0.0 111.403 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 44.5 mmtm 57.79 28.1 15.46 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.528 0.731 . . . . 0.0 109.589 -167.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 52.6 33.97 14.75 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.638 1.175 . . . . 0.0 112.61 -170.126 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -120.47 157.82 28.56 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.895 1.278 . . . . 0.0 108.09 169.403 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -62.1 152.85 31.64 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.277 0.631 . . . . 0.0 110.657 174.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -122.35 143.69 34.21 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 C-N-CA 124.898 1.279 . . . . 0.0 108.647 175.246 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 17.4 p30 -92.77 -177.59 4.59 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 125.162 1.385 . . . . 0.0 111.589 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 49.4 t80 -47.37 -60.63 2.38 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.677 0.791 . . . . 0.0 112.769 175.696 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 47.8 tp60 -63.17 -34.63 78.05 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 119.489 1.041 . . . . 0.0 110.579 -175.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 72.2 mm-40 -58.26 -49.86 75.61 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.943 -0.473 . . . . 0.0 110.498 173.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -55.15 -50.02 70.35 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 122.947 0.499 . . . . 0.0 110.512 173.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 26.3 mm -57.26 -34.3 45.52 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 C-N-CA 123.207 0.603 . . . . 0.0 110.534 177.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 61.1 m -71.13 -39.29 72.09 Favored 'General case' 0 CA--C 1.531 0.227 0 O-C-N 121.568 -0.708 . . . . 0.0 110.684 176.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -57.17 -53.75 54.62 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 118.902 0.774 . . . . 0.0 109.959 173.26 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 53.6 mt -58.57 -42.35 87.77 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.804 0.335 . . . . 0.0 110.854 174.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.42 -46.05 88.09 Favored Glycine 0 CA--C 1.524 0.608 0 C-N-CA 124.244 0.926 . . . . 0.0 111.083 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.3 -49.28 74.63 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.362 0.665 . . . . 0.0 110.001 177.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -49.49 -59.63 3.58 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 122.472 1.13 . . . . 0.0 109.879 176.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -49.01 -59.75 3.35 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 113.663 -1.608 . . . . 0.0 110.254 178.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 22.7 ttp -63.87 -40.27 96.15 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.199 0.6 . . . . 0.0 112.004 -173.644 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 70.0 mt -62.94 -48.94 85.63 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 CA-C-O 117.77 -1.11 . . . . 0.0 109.679 -179.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.43 1.2 p90 -79.02 -33.54 44.75 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 117.812 -1.555 . . . . 0.0 113.975 179.117 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 32.1 m-80 -79.98 89.01 5.32 Favored 'General case' 0 C--N 1.334 -0.066 0 O-C-N 121.019 -1.051 . . . . 0.0 109.66 175.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -42.04 -42.32 2.84 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.573 0.749 . . . . 0.0 111.082 169.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.23 16.77 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 114.854 1.428 . . . . 0.0 114.854 178.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 46.9 mt -130.26 2.91 4.7 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 125.136 1.374 . . . . 0.0 112.533 170.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 29.4 mmtp -66.61 85.24 0.11 Allowed 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 119.839 1.199 . . . . 0.0 111.561 -171.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.339 0 CA-C-O 117.206 -1.886 . . . . 0.0 109.544 176.434 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.6 ppp? . . . . . 0 N--CA 1.478 0.953 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -80.8 65.74 6.06 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 121.625 -0.672 . . . . 0.0 111.581 -173.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.4 m -58.9 167.47 1.92 Allowed Pre-proline 0 CA--C 1.539 0.53 0 C-N-CA 124.688 1.195 . . . . 0.0 111.404 175.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_exo -48.27 -47.57 19.41 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 123.234 2.623 . . . . 0.0 112.988 178.091 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.2 mt -57.11 -49.74 74.95 Favored 'General case' 0 C--O 1.224 -0.278 0 C-N-CA 120.672 -0.411 . . . . 0.0 111.391 173.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -59.12 -40.43 85.38 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-N 118.614 0.643 . . . . 0.0 110.276 -177.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -63.02 -52.3 63.42 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.405 0.682 . . . . 0.0 110.703 176.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.47 -46.3 89.11 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.599 0.76 . . . . 0.0 111.322 -177.788 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 74.2 mt -52.88 -57.45 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 169.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -43.56 -46.41 7.13 Favored Glycine 0 CA--C 1.527 0.819 0 C-N-CA 125.925 1.726 . . . . 0.0 112.456 177.408 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 mt -54.7 -57.12 12.76 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.681 0.792 . . . . 0.0 110.774 172.742 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 11.0 mp -57.62 -42.02 82.47 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.52 -0.737 . . . . 0.0 111.976 178.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 18.6 mt -57.36 -56.42 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 C-N-CA 123.828 0.851 . . . . 0.0 110.08 175.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.92 -49.79 60.98 Favored Glycine 0 CA--C 1.52 0.404 0 N-CA-C 109.723 -1.351 . . . . 0.0 109.723 -177.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.8 mm -53.84 -46.86 63.99 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 C-N-CA 122.734 0.413 . . . . 0.0 110.558 175.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . 0.406 ' HB2' ' CE2' ' B' ' 73' ' ' TYR . 42.3 t80 -56.61 -64.2 0.95 Allowed 'General case' 0 N--CA 1.457 -0.114 0 CA-C-N 118.529 0.604 . . . . 0.0 110.004 175.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -58.28 -34.96 71.09 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 119.351 -0.356 . . . . 0.0 111.313 -169.774 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 64.8 tttm -50.48 -36.61 34.46 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.7 0.8 . . . . 0.0 112.177 175.514 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 77.3 m-85 -104.29 -41.95 5.63 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.186 0.595 . . . . 0.0 111.4 -178.404 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 96.5 p -70.18 -36.32 74.57 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 121.556 -0.715 . . . . 0.0 111.349 -177.307 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -44.39 -44.18 7.88 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 124.938 1.256 . . . . 0.0 113.482 -173.4 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 6.6 ptpt -77.65 -16.02 58.8 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 113.391 0.886 . . . . 0.0 113.391 -175.163 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 53.7 mm-40 -78.24 37.83 0.27 Allowed 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 119.314 0.961 . . . . 0.0 112.819 -169.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 65.12 -75.08 0.08 OUTLIER Glycine 0 CA--C 1.53 0.985 0 C-N-CA 124.395 0.998 . . . . 0.0 111.165 -177.175 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 63.6 t0 -77.89 81.55 4.3 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 171.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 39.4 mtmt -36.23 -35.31 0.07 Allowed 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 128.019 2.528 . . . . 0.0 114.508 -177.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 16.3 m170 -94.76 17.4 13.62 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.768 0.827 . . . . 0.0 112.202 -172.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 51.7 p -141.73 162.04 36.45 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.104 0.961 . . . . 0.0 110.036 177.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -161.21 179.8 8.07 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 118.045 -0.979 . . . . 0.0 108.92 172.329 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.3 t -137.93 -168.04 2.27 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 120.421 1.464 . . . . 0.0 112.254 -178.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 14.9 pttp -45.69 -51.41 12.45 Favored 'General case' 0 C--N 1.337 0.06 0 C-N-CA 126.318 1.847 . . . . 0.0 112.969 -169.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -53.34 -49.88 66.17 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 122.99 0.516 . . . . 0.0 110.346 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 19.1 mp0 -68.06 -37.12 80.93 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 119.272 -0.394 . . . . 0.0 110.419 -178.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 43.7 mt -62.91 -45.94 90.14 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 118.928 0.786 . . . . 0.0 110.93 177.18 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -57.57 -50.87 71.69 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 173.064 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 59.4 tt0 -51.42 -53.29 38.28 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.056 0.942 . . . . 0.0 110.594 178.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 12.8 mt -52.22 -65.08 0.62 Allowed 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 125.839 1.656 . . . . 0.0 109.82 177.108 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 14.3 tt -59.4 -45.51 93.44 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 120.037 -0.665 . . . . 0.0 109.934 -173.067 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 20.3 tt0 -51.16 -59.39 4.24 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.681 0.792 . . . . 0.0 111.551 177.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 9.1 mttm -78.33 -53.6 7.11 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-O 121.388 0.613 . . . . 0.0 110.815 -173.234 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 68.0 mm-40 -77.14 -21.45 54.12 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 118.278 -0.868 . . . . 0.0 112.924 -169.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 11.1 mt -113.98 89.12 3.01 Favored 'General case' 0 N--CA 1.461 0.095 0 CA-C-N 120.263 1.392 . . . . 0.0 108.948 170.185 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 1.7 p -69.66 34.03 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.98 2.112 . . . . 0.0 113.179 -179.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 28.6 mt -83.47 69.36 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 -179.545 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.42 -47.29 89.13 Favored Glycine 0 CA--C 1.528 0.877 0 N-CA-C 109.284 -1.526 . . . . 0.0 109.284 171.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 26.4 p -71.13 75.8 0.68 Allowed 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 123.963 0.905 . . . . 0.0 108.611 169.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 62.3 mttm -48.23 94.69 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.552 1.541 . . . . 0.0 110.932 177.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 94.8 mt -48.46 -51.39 27.26 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 125.145 1.378 . . . . 0.0 112.555 -170.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -162.89 161.55 25.9 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 -173.056 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -37.17 -40.74 0.34 Allowed 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 127.671 2.388 . . . . 0.0 114.146 -171.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.34 -56.31 0.15 Allowed 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 126.1 1.76 . . . . 0.0 114.479 -179.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 62.6 tt0 -63.8 -44.61 92.79 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 121.257 0.551 . . . . 0.0 110.9 -175.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.5 mp -61.25 -52.5 60.68 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 73.4 t -56.29 -44.55 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 C-N-CA 124.249 1.02 . . . . 0.0 110.231 -179.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -53.92 -55.13 29.74 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 119.194 0.906 . . . . 0.0 110.497 173.013 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 46.4 mt -53.78 -42.87 68.75 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 119.18 -0.438 . . . . 0.0 111.524 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 24.5 mmt -68.45 -61.79 1.68 Allowed 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.765 0.793 . . . . 0.0 109.832 178.22 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -43.89 -43.52 6.45 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 127.085 2.154 . . . . 0.0 111.199 -177.388 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -39.13 -49.07 1.79 Allowed 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.831 1.253 . . . . 0.0 112.42 178.229 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -60.03 -56.35 22.71 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.28 0.491 . . . . 0.0 109.89 -177.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -61.79 -35.5 78.36 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 124.291 1.037 . . . . 0.0 111.482 -177.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 10.9 ttp180 -67.11 -52.24 44.28 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 123.759 0.824 . . . . 0.0 109.611 179.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -76.69 -58.38 3.32 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-O 119.628 -0.225 . . . . 0.0 110.558 -171.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 47.1 mtmt 48.56 44.77 21.1 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 121.193 0.521 . . . . 0.0 110.13 -169.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 70.74 -4.18 1.76 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.249 1.82 . . . . 0.0 113.927 -178.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -69.06 141.95 54.65 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 119.491 1.041 . . . . 0.0 109.1 176.086 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 41.5 mp0 -79.52 114.87 18.79 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 108.733 -0.839 . . . . 0.0 108.733 174.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 20.1 m -79.02 151.48 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 173.371 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -93.15 -175.93 4.0 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 123.832 0.853 . . . . 0.0 111.179 178.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -46.72 -66.08 0.46 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.109 0.964 . . . . 0.0 112.622 175.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 10.3 tp-100 -61.39 -35.1 76.54 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 119.756 1.162 . . . . 0.0 111.454 -174.056 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -64.51 -42.51 95.77 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 119.408 1.004 . . . . 0.0 111.252 175.424 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 73' ' ' TYR . . . . . 0.406 ' CE2' ' HB2' ' B' ' 16' ' ' PHE . 0.3 OUTLIER -54.81 -52.7 61.87 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 121.286 -0.884 . . . . 0.0 109.686 170.069 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 20.8 mm -53.68 -40.61 43.53 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.375 0 C-N-CA 122.947 0.499 . . . . 0.0 109.665 177.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 91.5 m -63.63 -28.37 69.87 Favored 'General case' 0 C--N 1.332 -0.178 0 C-N-CA 123.592 0.757 . . . . 0.0 111.338 178.307 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 10.7 t80 -60.51 -54.51 44.66 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.384 0.993 . . . . 0.0 108.996 171.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 70.1 mt -64.44 -37.98 89.44 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.183 0.593 . . . . 0.0 111.703 179.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -70.63 -45.03 55.6 Favored Glycine 0 CA--C 1.523 0.541 0 N-CA-C 110.047 -1.221 . . . . 0.0 110.047 -176.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.88 -46.24 90.25 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 122.294 -0.533 . . . . 0.0 109.898 173.456 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 26.4 tp -51.52 -57.99 7.55 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.211 0.529 . . . . 0.0 109.882 175.132 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.14 -51.99 38.84 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 124.42 1.088 . . . . 0.0 110.691 177.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 57.7 ttm -56.47 -51.01 70.06 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 124.316 1.047 . . . . 0.0 110.82 -178.515 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.3 mt -66.35 -51.03 63.02 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 CA-C-O 118.088 -0.958 . . . . 0.0 109.882 -173.507 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.464 0.1 OUTLIER -76.98 -40.25 47.47 Favored 'General case' 0 C--N 1.347 0.478 0 CA-C-N 119.716 1.144 . . . . 0.0 113.373 -177.302 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 19.3 m-80 -82.98 64.88 7.83 Favored 'General case' 0 N--CA 1.461 0.077 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 169.166 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -47.38 -26.49 1.32 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.945 1.698 . . . . 0.0 113.961 -172.018 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -38.81 -45.16 1.11 Allowed 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.505 1.522 . . . . 0.0 111.92 167.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 86.8 mt -67.92 6.65 0.66 Allowed 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.235 1.414 . . . . 0.0 113.758 -177.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 9.5 mtmp? -106.77 -4.53 19.26 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 119.517 1.053 . . . . 0.0 111.253 169.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.097 0 CA-C-O 117.663 -1.632 . . . . 0.0 110.675 -177.131 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.8 ptm . . . . . 0 N--CA 1.478 0.928 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -73.63 76.93 1.51 Allowed 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.409 0.684 . . . . 0.0 111.98 -170.601 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -53.5 163.82 0.95 Allowed Pre-proline 0 CA--C 1.54 0.568 0 C-N-CA 126.404 1.881 . . . . 0.0 111.627 172.552 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -51.65 -47.48 26.07 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 122.804 2.336 . . . . 0.0 112.309 176.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 8.6 mt -58.41 -50.43 73.71 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-N 118.322 0.51 . . . . 0.0 110.696 175.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -53.89 -48.81 69.73 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.147 0.431 . . . . 0.0 109.917 -178.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -57.78 -52.48 65.28 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.864 0.865 . . . . 0.0 110.919 177.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.31 -44.53 87.58 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.272 0.629 . . . . 0.0 111.781 -174.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 80.8 mt -54.54 -51.62 48.42 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 170.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.28 -49.64 14.37 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 124.358 0.98 . . . . 0.0 111.773 173.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.1 mt -55.61 -56.7 17.27 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 117.642 0.721 . . . . 0.0 111.094 174.561 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 9.9 mp -58.0 -43.39 86.58 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 119.357 0.98 . . . . 0.0 111.926 -177.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 75.4 mt -57.46 -55.88 18.5 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 C-N-CA 123.642 0.777 . . . . 0.0 110.131 174.035 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.81 -48.37 72.63 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.519 -1.032 . . . . 0.0 110.519 -177.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 7.4 mm -53.49 -48.57 57.8 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 C-N-CA 123.89 0.876 . . . . 0.0 109.975 174.278 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -56.47 -59.87 4.35 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.533 0.606 . . . . 0.0 109.96 177.076 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.6 t-80 -52.29 -38.34 58.12 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.218 1.007 . . . . 0.0 111.583 -177.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -56.51 -29.29 61.67 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.276 1.03 . . . . 0.0 112.163 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -110.8 -40.21 4.61 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.383 0.673 . . . . 0.0 112.262 -179.568 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 85.8 p -79.98 -46.34 16.84 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 119.462 1.028 . . . . 0.0 111.0 178.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -79.64 61.78 4.21 Favored Glycine 0 C--N 1.334 0.439 0 C-N-CA 124.955 1.264 . . . . 0.0 111.974 -169.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 21.5 mmmt -103.73 -52.74 2.91 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 171.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -169.24 176.62 5.12 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 126.068 1.747 . . . . 0.0 107.261 176.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 68.19 -149.3 49.92 Favored Glycine 0 CA--C 1.53 1.025 0 N-CA-C 112.219 -0.352 . . . . 0.0 112.219 174.166 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 62.8 t0 -78.99 68.81 5.03 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.342 0.657 . . . . 0.0 109.917 -173.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.8 ptmm? -61.3 -7.85 3.29 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 114.687 1.366 . . . . 0.0 114.687 -177.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 15.1 t-80 -75.95 -5.94 48.6 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.261 0.482 . . . . 0.0 110.193 170.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 19.2 p -135.46 165.11 26.26 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.192 1.397 . . . . 0.0 110.497 -179.287 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -160.74 167.1 27.55 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 124.808 1.243 . . . . 0.0 108.219 168.553 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 6.5 t -121.12 -169.88 1.92 Allowed 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 122.391 1.091 . . . . 0.0 113.575 -172.75 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 43.5 pttt -45.97 -55.76 6.4 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 127.879 2.472 . . . . 0.0 113.564 -169.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -56.3 -51.83 66.76 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 -178.019 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -57.98 -41.62 83.34 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.386 0.675 . . . . 0.0 110.891 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 42.3 mt -65.73 -48.76 70.83 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.496 0.589 . . . . 0.0 111.862 178.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -58.3 -46.15 86.66 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 121.786 -0.571 . . . . 0.0 109.805 176.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -58.05 -49.33 77.26 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-O 118.889 -0.577 . . . . 0.0 110.42 174.575 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.1 mt -48.24 -52.3 21.67 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 119.513 1.051 . . . . 0.0 110.114 177.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 49.3 mt -56.56 -62.63 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.206 174.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.5 tt0 -49.2 -46.74 46.1 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.325 0.65 . . . . 0.0 112.599 -173.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.9 mmpt? -80.94 -53.92 6.03 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 125.592 1.557 . . . . 0.0 110.149 -171.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -95.22 -14.57 23.94 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -168.005 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.7 mt -121.12 81.17 1.74 Allowed 'General case' 0 C--N 1.337 0.034 0 C-N-CA 125.327 1.451 . . . . 0.0 108.059 173.3 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 64.9 p -79.62 47.64 0.86 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.104 0.961 . . . . 0.0 109.924 -176.181 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 22.8 mt -84.1 75.22 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 -173.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -52.45 -46.95 57.75 Favored Glycine 0 CA--C 1.529 0.916 0 N-CA-C 110.084 -1.206 . . . . 0.0 110.084 171.198 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 6.1 m -70.89 67.62 0.4 Allowed 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.376 1.07 . . . . 0.0 110.166 171.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 63.3 mmtt -46.27 92.03 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.838 2.055 . . . . 0.0 112.47 -174.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 90.4 mt -62.6 112.78 2.63 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.103 0.961 . . . . 0.0 113.103 -170.246 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 67.86 -69.01 0.15 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 126.544 1.937 . . . . 0.0 114.086 167.23 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.6 p-10 -179.21 -38.92 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 125.724 1.609 . . . . 0.0 110.253 -170.376 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -36.2 -58.82 0.66 Allowed 'General case' 0 C--O 1.226 -0.17 0 C-N-CA 125.352 1.461 . . . . 0.0 113.593 -173.208 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -65.74 -39.87 91.55 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 120.771 0.319 . . . . 0.0 111.057 -173.076 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 2.1 mp -61.14 -54.88 29.16 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 178.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 80.6 t -56.25 -45.31 81.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 C-N-CA 123.973 0.909 . . . . 0.0 110.285 -179.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.19 -52.83 63.73 Favored 'General case' 0 C--O 1.23 0.053 0 CA-C-N 118.846 0.748 . . . . 0.0 110.235 176.367 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 61.5 mt -55.0 -40.44 70.13 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 119.282 -0.39 . . . . 0.0 111.192 -179.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.25 -67.74 0.44 Allowed 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 118.523 0.601 . . . . 0.0 109.645 174.23 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -39.7 -41.3 1.06 Allowed 'General case' 0 C--N 1.34 0.152 0 C-N-CA 127.37 2.268 . . . . 0.0 112.097 -177.125 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -38.64 -49.96 1.58 Allowed 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.825 1.25 . . . . 0.0 112.19 175.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.7 pp -60.87 -41.56 96.19 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 118.333 0.515 . . . . 0.0 110.95 -176.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -71.46 -42.72 67.82 Favored 'General case' 0 N--CA 1.457 -0.11 0 C-N-CA 123.619 0.768 . . . . 0.0 109.762 -178.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 14.5 ttm180 -59.1 -48.28 82.17 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.894 0.877 . . . . 0.0 110.208 178.464 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 8.4 m-80 -84.61 -47.9 10.05 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.547 0.339 . . . . 0.0 111.696 -171.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 57.9 mttp 54.64 -95.07 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.141 0.977 . . . . 0.0 109.185 -167.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -140.88 42.63 1.83 Allowed 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 119.039 0.836 . . . . 0.0 109.862 169.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -118.81 156.04 30.11 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.596 1.158 . . . . 0.0 108.853 172.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -87.22 130.03 34.73 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 169.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 11.0 m -79.55 143.3 12.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 170.206 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -83.38 167.81 17.18 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 122.78 0.432 . . . . 0.0 111.382 177.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 61.1 t80 -37.4 -59.18 0.78 Allowed 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.508 1.123 . . . . 0.0 113.149 177.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 53.8 tp60 -64.9 -32.22 73.82 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 119.716 1.144 . . . . 0.0 111.153 -175.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -68.87 -40.27 79.38 Favored 'General case' 0 CA--C 1.533 0.304 0 O-C-N 121.537 -0.727 . . . . 0.0 110.539 176.672 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -56.14 -51.94 66.13 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 169.584 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.416 ' CG2' ' CG2' ' B' ' 74' ' ' ILE . 24.5 mm -56.78 -35.86 47.5 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 O-C-N 121.915 -0.491 . . . . 0.0 110.305 176.669 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 90.2 m -71.69 -34.52 69.73 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 119.217 0.917 . . . . 0.0 111.42 176.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -58.73 -51.93 67.86 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 119.106 0.866 . . . . 0.0 108.923 171.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 64.3 mt -59.96 -40.92 90.68 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 120.926 0.393 . . . . 0.0 111.322 174.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -59.7 -47.28 91.69 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 110.533 -1.027 . . . . 0.0 110.533 -179.772 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.03 -48.3 82.4 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.925 0.89 . . . . 0.0 109.694 176.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 8.9 tp -51.06 -60.27 3.28 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-O 121.981 0.896 . . . . 0.0 110.002 177.031 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -49.14 -54.93 14.02 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 125.518 1.527 . . . . 0.0 110.528 179.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 18.4 ttp -67.92 -33.6 75.0 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.772 0.829 . . . . 0.0 111.99 -174.199 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 90.9 mt -67.49 -58.42 6.29 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.346 0 CA-C-O 118.407 -0.806 . . . . 0.0 108.99 176.3 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.417 0.7 OUTLIER -70.8 -38.89 73.37 Favored 'General case' 0 C--N 1.346 0.436 0 C-N-CA 118.173 -1.411 . . . . 0.0 112.521 -174.542 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 29.7 m-80 -82.18 65.44 7.31 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 168.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -46.99 -32.58 3.99 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.517 1.127 . . . . 0.0 113.004 -172.104 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.94 -52.25 0.43 Allowed 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.85 1.66 . . . . 0.0 112.494 168.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 90.1 mt -61.45 -16.06 43.27 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.2 1.0 . . . . 0.0 113.455 -174.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -65.34 -20.97 66.63 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 119.031 0.832 . . . . 0.0 111.285 173.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.181 0 CA-C-O 116.824 -2.098 . . . . 0.0 112.504 178.006 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 96.3 mmm . . . . . 0 N--CA 1.474 0.76 0 CA-C-O 120.678 0.275 . . . . 0.0 110.288 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.08 68.89 3.29 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 121.983 -0.448 . . . . 0.0 110.222 176.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.7 m -51.26 159.86 1.02 Allowed Pre-proline 0 CA--C 1.537 0.468 0 C-N-CA 124.959 1.304 . . . . 0.0 110.688 173.625 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_exo -44.81 -49.87 9.09 Favored 'Trans proline' 0 N--CA 1.459 -0.52 0 C-N-CA 123.276 2.65 . . . . 0.0 113.401 -178.423 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.4 mt -57.95 -53.42 58.47 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 174.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -58.35 -40.44 82.22 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 118.265 0.484 . . . . 0.0 110.029 -175.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -64.12 -50.69 67.27 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.462 1.105 . . . . 0.0 110.52 178.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.35 -46.12 91.54 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.602 0.715 . . . . 0.0 111.103 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 64.9 mt -52.8 -53.01 23.13 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 170.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.76 -47.25 24.75 Favored Glycine 0 CA--C 1.527 0.796 0 C-N-CA 125.172 1.368 . . . . 0.0 111.784 176.082 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 mt -55.93 -55.34 33.82 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 117.606 0.703 . . . . 0.0 110.89 173.63 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -57.54 -43.66 84.55 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 118.864 0.757 . . . . 0.0 111.612 -179.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 89.1 mt -58.35 -52.75 55.32 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 C-N-CA 123.554 0.741 . . . . 0.0 110.69 174.414 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.0 -51.97 50.08 Favored Glycine 0 CA--C 1.523 0.543 0 N-CA-C 109.614 -1.394 . . . . 0.0 109.614 -178.026 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 9.1 mm -53.51 -49.93 52.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 C-N-CA 123.635 0.774 . . . . 0.0 110.474 175.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -51.76 -59.46 4.28 Favored 'General case' 0 C--N 1.339 0.134 0 CA-C-O 120.929 0.395 . . . . 0.0 110.059 178.321 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 67.9 t60 -55.04 -46.39 75.31 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.262 0.625 . . . . 0.0 110.635 -177.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -51.15 -28.83 11.89 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 125.546 1.539 . . . . 0.0 112.721 -179.423 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -132.27 44.6 2.87 Favored 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 119.006 0.821 . . . . 0.0 110.01 173.367 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 58.6 p -83.11 -102.31 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 121.601 0.715 . . . . 0.0 111.769 -176.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -139.63 62.95 0.55 Allowed Glycine 0 C--N 1.333 0.374 0 N-CA-C 109.631 -1.388 . . . . 0.0 109.631 -168.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 30.1 mmtp -50.63 -33.36 21.97 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.716 1.207 . . . . 0.0 112.322 -174.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -62.46 -20.59 64.69 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -177.15 -87.28 0.07 OUTLIER Glycine 0 CA--C 1.525 0.712 0 CA-C-N 118.545 0.612 . . . . 0.0 111.726 178.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -78.47 95.72 5.21 Favored 'General case' 0 C--N 1.338 0.091 0 CA-C-N 117.307 0.553 . . . . 0.0 109.556 -173.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 18.9 mttm -79.04 42.78 0.48 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.864 0.866 . . . . 0.0 112.168 -174.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 19.2 m80 -144.61 0.87 1.01 Allowed 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 127.349 2.26 . . . . 0.0 111.358 -173.065 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 3.4 p -128.84 169.85 14.08 Favored 'General case' 0 C--O 1.232 0.151 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 169.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 4.3 pp -159.34 -170.84 3.1 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.593 0.757 . . . . 0.0 109.619 175.247 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 14.4 m -149.69 178.82 8.52 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.125 -0.984 . . . . 0.0 111.357 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 19.4 pttm -37.23 -53.2 1.06 Allowed 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 126.576 1.95 . . . . 0.0 113.727 -179.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 23.1 ttmm -50.98 -50.35 58.39 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.782 0.833 . . . . 0.0 110.544 178.119 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 25.8 mp0 -67.39 -39.01 85.56 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 118.723 -0.656 . . . . 0.0 110.143 -178.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 78.0 mt -60.36 -46.43 89.98 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.373 0.988 . . . . 0.0 111.127 175.476 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -56.8 -51.43 68.96 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 175.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -55.64 -48.22 75.33 Favored 'General case' 0 C--O 1.22 -0.448 0 CA-C-N 117.861 0.3 . . . . 0.0 111.361 175.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 15.1 mt -51.77 -53.52 38.84 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 121.504 -0.748 . . . . 0.0 109.776 -178.739 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 1.4 mp -57.13 -58.14 7.13 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 174.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -53.5 -47.77 69.58 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.574 0.75 . . . . 0.0 112.037 -172.085 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 10.7 mmpt? -82.66 -49.39 9.86 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 125.204 1.402 . . . . 0.0 110.211 -173.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 52.7 mm-40 -98.98 -2.47 37.29 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-O 117.248 -1.358 . . . . 0.0 114.424 -167.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 72.1 mt -126.03 90.04 3.13 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 120.673 1.579 . . . . 0.0 110.214 169.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 37.9 p -73.79 65.87 1.06 Allowed 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.201 1.0 . . . . 0.0 108.302 169.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 10.8 tt -78.24 59.2 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 124.96 1.304 . . . . 0.0 111.725 -169.202 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 63.94 -76.95 0.05 OUTLIER Glycine 0 CA--C 1.526 0.754 0 C-N-CA 125.882 1.706 . . . . 0.0 111.312 -178.077 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 36.7 m -163.63 56.69 0.17 Allowed 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 126.659 1.984 . . . . 0.0 107.24 176.342 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp 55.67 51.28 12.77 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.128 0.971 . . . . 0.0 110.204 -173.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 4.3 pp -72.02 138.35 47.86 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 119.684 -0.806 . . . . 0.0 110.069 174.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 72.75 119.7 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.677 1.991 . . . . 0.0 113.003 171.635 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -42.23 -38.98 1.92 Allowed 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 127.12 2.168 . . . . 0.0 114.959 -169.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.94 -60.58 0.16 Allowed 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 125.851 1.661 . . . . 0.0 113.524 -178.362 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -68.55 -34.57 76.08 Favored 'General case' 0 N--CA 1.457 -0.111 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -174.085 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.2 mp -65.87 -52.54 48.25 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 -178.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 80.3 t -54.31 -45.49 68.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 C-N-CA 123.699 0.799 . . . . 0.0 110.093 174.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.41 -50.64 72.36 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 118.482 0.583 . . . . 0.0 110.926 177.263 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 54.4 mt -56.19 -39.87 73.09 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.202 0.601 . . . . 0.0 111.284 178.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.44 -64.95 0.75 Allowed 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 118.762 0.71 . . . . 0.0 109.085 174.186 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -40.51 -42.51 1.66 Allowed 'General case' 0 N--CA 1.463 0.209 0 C-N-CA 126.637 1.975 . . . . 0.0 111.943 -178.147 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -38.13 -48.65 1.26 Allowed 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 126.001 1.72 . . . . 0.0 112.634 177.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.6 pp -63.11 -42.23 99.51 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 121.078 -0.249 . . . . 0.0 110.833 -176.288 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -73.59 -37.76 65.34 Favored 'General case' 0 N--CA 1.457 -0.085 0 C-N-CA 123.791 0.836 . . . . 0.0 110.257 -178.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 15.6 ttm180 -58.38 -48.5 80.4 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.325 0.65 . . . . 0.0 109.614 175.092 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -81.7 -66.61 0.87 Allowed 'General case' 0 C--O 1.232 0.166 0 C-N-CA 122.222 0.209 . . . . 0.0 111.311 -174.412 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 23.1 mtmm 61.84 -75.89 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.733 1.613 . . . . 0.0 108.76 -167.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -138.49 -12.38 1.35 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.556 1.542 . . . . 0.0 112.087 175.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.6 104.26 8.03 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 118.997 0.817 . . . . 0.0 109.979 -173.128 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 26.9 mp0 -49.8 124.68 10.22 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.647 0.779 . . . . 0.0 109.368 169.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 29.5 m -85.91 155.86 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 CA-C-O 121.33 0.586 . . . . 0.0 109.896 -177.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 16.7 p30 -105.17 -176.79 3.18 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 126.184 1.794 . . . . 0.0 110.928 179.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -52.93 -63.48 1.13 Allowed 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 123.637 0.775 . . . . 0.0 112.183 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -62.76 -32.68 73.87 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 119.703 1.138 . . . . 0.0 111.327 -175.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -59.16 -50.52 73.72 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 119.525 1.057 . . . . 0.0 110.666 173.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -53.9 -49.75 67.9 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.957 -0.464 . . . . 0.0 110.227 173.245 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.416 ' CG2' ' CG2' ' A' ' 74' ' ' ILE . 26.2 mm -60.85 -27.18 40.65 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 O-C-N 121.934 -0.479 . . . . 0.0 111.18 177.343 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 83.6 m -76.12 -33.94 59.46 Favored 'General case' 0 C--N 1.333 -0.114 0 O-C-N 120.898 -1.126 . . . . 0.0 110.154 173.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -57.34 -57.98 10.26 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 169.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 48.4 mt -61.37 -40.31 93.84 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 120.943 0.401 . . . . 0.0 111.996 179.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.3 -47.06 65.81 Favored Glycine 0 CA--C 1.524 0.651 0 N-CA-C 110.721 -0.952 . . . . 0.0 110.721 -176.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.28 -44.58 87.54 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 121.867 -0.784 . . . . 0.0 110.174 176.228 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 13.9 tp -48.29 -56.83 7.04 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.604 0.761 . . . . 0.0 110.145 172.55 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.05 -55.0 23.39 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.474 1.11 . . . . 0.0 110.612 175.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 39.5 ttm -51.33 -47.13 62.79 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.243 1.017 . . . . 0.0 110.982 -178.136 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 60.6 mt -68.8 -61.21 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-O 118.321 -0.847 . . . . 0.0 110.566 178.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.39 0.3 OUTLIER -65.7 -44.47 86.06 Favored 'General case' 0 C--N 1.346 0.434 0 C-N-CA 117.891 -1.524 . . . . 0.0 112.02 -171.331 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 64.7 m-80 -82.94 62.57 6.57 Favored 'General case' 0 C--O 1.228 -0.047 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 169.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -49.21 -30.07 6.49 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.196 1.398 . . . . 0.0 112.268 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -40.37 -37.94 0.74 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.795 1.638 . . . . 0.0 113.138 169.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 28.5 mt -53.42 -38.84 63.86 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.788 0.835 . . . . 0.0 111.988 176.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 65.1 mttm -75.32 54.41 0.72 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.342 1.057 . . . . 0.0 111.4 -175.385 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.09 0 CA-C-O 117.729 -1.595 . . . . 0.0 109.965 178.807 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.3 mpp? . . . . . 0 N--CA 1.474 0.746 0 CA-C-O 120.74 0.305 . . . . 0.0 110.852 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -76.56 70.96 3.15 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.141 0.577 . . . . 0.0 110.75 -176.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.1 m -57.39 165.78 1.95 Allowed Pre-proline 0 CA--C 1.54 0.594 0 C-N-CA 124.915 1.286 . . . . 0.0 111.885 178.039 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -47.19 -47.43 17.11 Favored 'Trans proline' 0 N--CA 1.458 -0.578 0 C-N-CA 123.575 2.85 . . . . 0.0 113.376 178.735 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.7 mt -55.42 -49.62 71.93 Favored 'General case' 0 C--N 1.341 0.204 0 CA-C-N 118.01 0.368 . . . . 0.0 111.495 173.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -61.52 -41.31 97.13 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 -176.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 17.0 tt0 -60.48 -51.78 67.99 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.33 0.652 . . . . 0.0 110.831 175.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.06 -45.83 90.35 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.527 0.731 . . . . 0.0 111.227 -177.296 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 66.7 mt -53.1 -53.5 22.16 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 169.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -45.78 -47.83 13.49 Favored Glycine 0 CA--C 1.528 0.902 0 C-N-CA 125.188 1.375 . . . . 0.0 112.156 175.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.0 mt -54.95 -56.48 19.19 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 117.733 0.766 . . . . 0.0 110.861 173.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.4 mp -58.17 -43.95 87.73 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 121.611 -0.681 . . . . 0.0 111.601 -179.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 60.7 mt -55.41 -56.04 13.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.18 0 C-N-CA 123.727 0.811 . . . . 0.0 109.975 174.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.01 -49.63 61.92 Favored Glycine 0 CA--C 1.523 0.56 0 N-CA-C 110.268 -1.133 . . . . 0.0 110.268 -177.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 8.8 mm -53.34 -48.5 56.16 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 C-N-CA 123.242 0.617 . . . . 0.0 110.454 176.52 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -56.54 -60.93 2.82 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 121.684 0.754 . . . . 0.0 109.892 175.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -53.76 -37.39 63.36 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.854 1.262 . . . . 0.0 111.616 -172.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.5 tttp -50.28 -36.92 33.59 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.2 1.0 . . . . 0.0 111.855 177.151 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -102.28 -52.14 3.2 Favored 'General case' 0 CA--C 1.528 0.111 0 C-N-CA 123.064 0.545 . . . . 0.0 109.682 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.6 m -59.41 -37.77 78.89 Favored 'General case' 0 N--CA 1.453 -0.292 0 O-C-N 121.759 -0.588 . . . . 0.0 112.431 -175.549 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -72.89 63.72 1.58 Allowed Glycine 0 C--N 1.339 0.721 0 C-N-CA 124.394 0.997 . . . . 0.0 113.055 -172.452 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.5 pttp -170.12 -33.69 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.728 1.611 . . . . 0.0 111.196 174.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -76.72 38.63 0.2 Allowed 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 119.647 1.112 . . . . 0.0 113.693 -173.841 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.01 -75.89 0.12 Allowed Glycine 0 CA--C 1.53 0.998 0 O-C-N 121.399 -0.813 . . . . 0.0 111.203 -175.597 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 67.1 t0 -78.71 78.57 5.15 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 13.0 ptmm? -60.79 -9.93 4.76 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 -178.694 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 26.5 t-80 -78.62 -11.58 59.98 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.844 0.747 . . . . 0.0 111.349 173.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.9 p -122.35 166.43 14.71 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 125.603 1.561 . . . . 0.0 111.431 178.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -151.62 164.34 37.1 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 124.088 0.955 . . . . 0.0 109.079 168.12 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 84.3 p -87.04 165.28 15.93 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.66 1.184 . . . . 0.0 113.125 -172.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 24.2 pttm -48.83 -47.34 42.54 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.395 168.075 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -57.28 -53.28 59.88 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 124.542 1.137 . . . . 0.0 109.37 178.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -56.62 -43.65 80.42 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 118.208 -0.901 . . . . 0.0 111.812 178.146 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.8 mt -60.4 -52.29 65.84 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 119.881 1.219 . . . . 0.0 111.597 175.549 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.9 mtmt -58.48 -38.21 77.12 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 122.374 0.27 . . . . 0.0 110.803 -178.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -60.62 -70.39 0.18 Allowed 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 168.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.3 mt -32.16 -60.23 0.28 Allowed 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 126.175 1.79 . . . . 0.0 112.341 -176.397 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 15.4 tt -56.34 -54.17 31.21 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 O-C-N 123.464 0.477 . . . . 0.0 109.874 -173.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -69.01 -40.46 78.66 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.851 -0.531 . . . . 0.0 111.733 -176.389 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.8 mmpt? -60.93 -54.26 47.14 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 123.692 0.797 . . . . 0.0 109.691 -178.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 65.8 mm-40 -84.68 -49.96 8.05 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.399 -169.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 98.4 mt -78.0 73.88 4.55 Favored 'General case' 0 C--N 1.339 0.128 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 170.428 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 21.0 p -50.5 -43.97 55.85 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 170.029 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . 0.271 4.3 tt 52.06 -56.38 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 C-N-CA 130.195 3.398 . . . . 0.0 117.444 167.681 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 135.99 -162.42 24.99 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 107.017 -2.433 . . . . 0.0 107.017 -170.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 3.7 m -74.02 60.6 0.78 Allowed 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.988 0.915 . . . . 0.0 112.84 -174.35 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 61.2 mttp 49.26 61.74 2.98 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.726 1.211 . . . . 0.0 110.091 178.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 26.2 mt -44.61 -43.69 8.36 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 115.608 1.707 . . . . 0.0 115.608 -168.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 44.3 tt0 -147.51 140.3 24.87 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 118.473 0.579 . . . . 0.0 109.935 -168.406 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -36.68 -44.74 0.48 Allowed 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 128.47 2.708 . . . . 0.0 113.748 -169.288 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -36.87 -51.16 0.89 Allowed 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 124.661 1.184 . . . . 0.0 112.799 179.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -65.95 -39.32 90.34 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 121.256 0.55 . . . . 0.0 111.103 -175.195 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 1.1 mp -65.36 -51.98 57.71 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 N-CA-C 106.904 -1.517 . . . . 0.0 106.904 -179.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 84.6 t -56.69 -44.17 80.76 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 C-N-CA 123.892 0.877 . . . . 0.0 110.324 178.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -56.65 -53.45 57.5 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 118.65 0.659 . . . . 0.0 110.195 173.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 40.8 mt -53.13 -44.3 67.61 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 119.204 -0.427 . . . . 0.0 111.521 178.662 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 26.2 mmt -64.89 -57.82 7.79 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.797 0.808 . . . . 0.0 109.885 177.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -56.29 -32.94 65.05 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 125.272 1.429 . . . . 0.0 111.835 -173.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -38.59 -47.66 1.34 Allowed 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 125.314 1.446 . . . . 0.0 112.397 -178.191 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -55.83 -48.33 75.65 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 122.348 0.259 . . . . 0.0 110.708 -178.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -67.61 -45.34 75.72 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 123.139 0.576 . . . . 0.0 110.198 176.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 14.2 ttt85 -53.46 -43.5 68.16 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.954 0.902 . . . . 0.0 111.014 -178.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 16.3 m-80 -84.8 -5.54 59.33 Favored 'General case' 0 N--CA 1.462 0.138 0 C-N-CA 123.95 0.9 . . . . 0.0 112.401 177.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 93.0 mttt 45.56 48.62 11.12 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.605 1.162 . . . . 0.0 110.023 -168.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 56.91 26.74 12.08 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 126.411 1.884 . . . . 0.0 113.196 -178.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -137.83 -100.69 0.19 Allowed 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.952 0.901 . . . . 0.0 111.76 179.638 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.5 mp0 -135.61 167.03 21.86 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 125.659 1.584 . . . . 0.0 111.107 -168.31 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 15.5 m -137.03 156.31 34.13 Favored 'Isoleucine or valine' 0 C--O 1.235 0.303 0 C-N-CA 125.37 1.468 . . . . 0.0 108.844 168.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -88.67 168.48 12.48 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 124.016 0.926 . . . . 0.0 111.622 175.142 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -36.63 -62.0 0.49 Allowed 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.512 1.125 . . . . 0.0 113.447 172.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 43.7 tp60 -63.29 -34.09 76.94 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 120.851 -1.156 . . . . 0.0 111.235 -174.28 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -66.28 -41.4 89.87 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.366 -0.834 . . . . 0.0 110.371 175.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -54.49 -49.27 70.53 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 121.614 -0.678 . . . . 0.0 109.651 169.74 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.407 ' CG2' ' CG2' ' B' ' 74' ' ' ILE . 29.6 mm -58.65 -32.8 47.09 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 O-C-N 121.764 -0.585 . . . . 0.0 110.676 175.3 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 25.5 m -72.13 -30.97 65.58 Favored 'General case' 0 CA--C 1.534 0.345 0 O-C-N 121.232 -0.917 . . . . 0.0 111.253 175.363 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -61.77 -56.48 19.05 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.083 -1.011 . . . . 0.0 108.739 171.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 49.2 mt -61.49 -41.97 98.08 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 120.875 0.369 . . . . 0.0 111.418 178.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.8 -46.36 89.88 Favored Glycine 0 CA--C 1.523 0.587 0 N-CA-C 110.663 -0.975 . . . . 0.0 110.663 -178.215 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.97 -45.91 92.84 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 117.97 0.885 . . . . 0.0 110.423 174.758 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 16.8 tp -51.73 -55.74 17.85 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.18 0.514 . . . . 0.0 109.807 176.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.83 -56.14 15.74 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 124.75 1.22 . . . . 0.0 110.163 179.261 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 54.5 ttm -50.43 -52.6 36.32 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 125.6 1.56 . . . . 0.0 110.574 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 71.3 mt -64.84 -64.41 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.346 0 CA-C-O 118.748 -0.644 . . . . 0.0 109.403 -177.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.448 0.1 OUTLIER -67.47 -37.1 82.39 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 118.314 -1.354 . . . . 0.0 113.253 -169.245 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 24.1 m-80 -81.51 68.79 7.98 Favored 'General case' 0 N--CA 1.461 0.101 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 170.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -37.62 -46.64 0.88 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.503 1.521 . . . . 0.0 111.619 -176.074 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -30.93 -53.51 0.19 Allowed 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 126.756 2.022 . . . . 0.0 113.506 171.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 18.7 mt -46.98 -40.37 14.3 Favored 'General case' 0 C--O 1.224 -0.261 0 C-N-CA 123.996 0.919 . . . . 0.0 111.95 -178.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 53.4 mtmt -65.76 -15.64 63.03 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -173.743 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.052 0 CA-C-O 116.878 -2.068 . . . . 0.0 110.609 174.025 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 55.5 ttp . . . . . 0 N--CA 1.473 0.698 0 CA-C-O 120.636 0.255 . . . . 0.0 110.395 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -75.25 74.69 2.38 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 120.794 0.33 . . . . 0.0 110.621 -178.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 13.0 m -50.74 156.37 1.63 Allowed Pre-proline 0 CA--C 1.542 0.656 0 C-N-CA 123.56 0.744 . . . . 0.0 111.008 170.668 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -47.11 -51.5 9.29 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 123.23 2.62 . . . . 0.0 113.465 -178.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 4.9 mt -52.79 -46.89 67.84 Favored 'General case' 0 C--O 1.227 -0.124 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 172.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -63.48 -40.62 97.58 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 118.16 0.436 . . . . 0.0 110.1 -177.045 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 14.1 tp60 -63.4 -46.3 87.07 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 122.438 0.295 . . . . 0.0 110.7 175.47 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.76 -47.02 85.33 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.357 0.599 . . . . 0.0 110.872 -179.157 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 65.1 mt -53.15 -53.39 23.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 169.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.29 -44.8 21.11 Favored Glycine 0 CA--C 1.527 0.822 0 C-N-CA 125.588 1.566 . . . . 0.0 112.02 176.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.6 mt -57.27 -55.57 33.11 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 117.569 0.685 . . . . 0.0 110.587 173.612 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.9 mp -57.86 -41.99 83.58 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 118.996 0.816 . . . . 0.0 111.647 179.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 66.7 mt -57.13 -56.37 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 C-N-CA 123.841 0.856 . . . . 0.0 110.736 173.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.07 -50.55 58.62 Favored Glycine 0 CA--C 1.521 0.444 0 N-CA-C 109.751 -1.34 . . . . 0.0 109.751 -177.206 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 12.5 mm -52.1 -49.06 41.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 C-N-CA 123.47 0.708 . . . . 0.0 110.474 174.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -55.49 -65.36 0.6 Allowed 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 118.31 0.505 . . . . 0.0 110.18 178.335 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -58.92 -30.67 68.01 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 118.205 -0.902 . . . . 0.0 112.707 -174.398 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 65.3 tttp -49.13 -36.71 19.75 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 119.301 0.955 . . . . 0.0 111.293 173.33 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -100.68 -56.73 2.26 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 122.935 0.494 . . . . 0.0 110.169 177.459 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m -51.76 -39.77 59.12 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.832 0.742 . . . . 0.0 111.589 -176.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -33.96 -56.33 0.67 Allowed Glycine 0 C--N 1.338 0.686 0 C-N-CA 125.606 1.574 . . . . 0.0 113.275 173.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.3 -7.61 43.87 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 114.581 1.326 . . . . 0.0 114.581 -168.518 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -104.36 14.84 29.44 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 119.472 1.033 . . . . 0.0 112.269 173.554 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 77.89 -61.44 3.71 Favored Glycine 0 CA--C 1.527 0.798 0 O-C-N 121.621 -0.675 . . . . 0.0 112.508 168.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 61.7 t0 -78.28 63.21 3.13 Favored 'General case' 0 C--O 1.232 0.174 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 175.195 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 21.5 pttp -70.98 4.79 2.38 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 125.261 1.424 . . . . 0.0 113.789 -169.218 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 23.6 t-160 -76.92 -16.14 59.46 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 124.55 1.14 . . . . 0.0 109.055 167.5 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 32.2 p -133.48 160.83 36.25 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 125.177 1.391 . . . . 0.0 111.429 -174.208 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -161.34 177.72 9.88 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.831 1.252 . . . . 0.0 108.668 168.477 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.4 t -131.83 -169.44 2.2 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 120.259 1.39 . . . . 0.0 112.241 -175.112 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 19.2 pttp -42.25 -53.54 4.07 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 127.877 2.471 . . . . 0.0 113.227 -174.062 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 3.2 tppp? -55.67 -53.41 56.94 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 123.517 0.727 . . . . 0.0 109.568 -178.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 28.2 mp0 -64.44 -38.04 89.64 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.289 -176.65 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 43.6 mt -61.9 -52.59 63.46 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 118.542 0.61 . . . . 0.0 111.228 177.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -61.88 -43.78 98.14 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.545 -0.722 . . . . 0.0 110.506 178.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 71.6 tt0 -53.24 -51.96 60.51 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.758 0.823 . . . . 0.0 110.363 174.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 7.9 mt -49.49 -56.95 8.01 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 124.552 1.141 . . . . 0.0 110.13 177.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 33.7 mm -53.92 -58.99 2.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 177.503 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -54.31 -47.06 72.88 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.272 0.629 . . . . 0.0 112.425 -172.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -78.1 -56.28 4.6 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 122.096 -0.377 . . . . 0.0 110.745 -178.316 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -82.59 -20.55 36.26 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 -167.163 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 76.1 mt -110.76 90.13 3.24 Favored 'General case' 0 N--CA 1.457 -0.115 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 168.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 64.2 p -76.36 55.89 1.03 Allowed 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 124.255 1.022 . . . . 0.0 109.259 178.057 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 50.5 mt -100.33 73.07 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 N-CA-C 106.454 -1.684 . . . . 0.0 106.454 -178.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.5 -48.79 84.29 Favored Glycine 0 CA--C 1.528 0.902 0 N-CA-C 109.184 -1.567 . . . . 0.0 109.184 172.282 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 23.2 p -71.28 74.38 0.71 Allowed 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 124.128 0.971 . . . . 0.0 108.674 169.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 47.6 mttp -51.01 95.17 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 125.487 1.515 . . . . 0.0 111.113 179.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 95.5 mt -42.27 -54.04 3.88 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 126.489 1.916 . . . . 0.0 112.973 -171.145 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -163.27 160.14 23.51 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 106.723 -1.584 . . . . 0.0 106.723 -172.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -36.62 -41.66 0.32 Allowed 'General case' 0 C--O 1.226 -0.136 0 C-N-CA 127.932 2.493 . . . . 0.0 114.184 -171.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.4 -57.41 0.15 Allowed 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 126.027 1.731 . . . . 0.0 113.906 -178.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -67.4 -41.91 84.15 Favored 'General case' 0 N--CA 1.457 -0.083 0 CA-C-O 120.849 0.356 . . . . 0.0 111.166 -174.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.4 mp -60.65 -52.08 65.64 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 N-CA-C 107.066 -1.457 . . . . 0.0 107.066 179.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 78.4 t -54.49 -53.37 31.52 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 C-N-CA 123.914 0.886 . . . . 0.0 109.428 177.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -50.28 -55.17 16.57 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 119.317 0.962 . . . . 0.0 110.927 176.932 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 68.1 mt -54.67 -43.47 72.45 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 122.593 0.357 . . . . 0.0 111.655 -175.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -75.55 -59.67 2.65 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 118.097 0.408 . . . . 0.0 111.09 177.857 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -40.88 -43.71 2.12 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 126.458 1.903 . . . . 0.0 111.447 178.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -38.52 -49.01 1.47 Allowed 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 125.046 1.338 . . . . 0.0 112.547 176.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -58.6 -47.02 85.72 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 -176.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -67.91 -44.04 77.85 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 122.736 0.415 . . . . 0.0 110.724 178.44 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 11.2 ttp180 -56.55 -46.28 80.79 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.664 0.786 . . . . 0.0 110.095 -178.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -84.51 -54.08 4.99 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 122.879 0.472 . . . . 0.0 111.179 -174.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp 64.19 -80.67 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 -165.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -148.3 21.61 1.07 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.958 1.303 . . . . 0.0 110.798 169.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -77.51 143.45 38.43 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 121.611 -0.681 . . . . 0.0 109.466 178.243 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -89.44 107.97 19.38 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 106.237 -1.764 . . . . 0.0 106.237 168.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 12.2 m -78.17 140.22 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 -179.181 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -81.36 167.06 19.88 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.551 0.215 . . . . 0.0 110.71 175.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -32.37 -61.04 0.27 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.978 1.311 . . . . 0.0 112.902 171.589 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 37.8 tp60 -61.35 -33.3 73.39 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.604 1.093 . . . . 0.0 112.128 -174.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -72.53 -38.77 67.94 Favored 'General case' 0 C--O 1.236 0.35 0 O-C-N 121.338 -0.851 . . . . 0.0 110.16 177.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -56.14 -50.74 70.27 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 169.675 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.407 ' CG2' ' CG2' ' A' ' 74' ' ' ILE . 25.8 mm -55.82 -41.17 65.31 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 175.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 58.4 m -60.03 -37.95 81.28 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 118.976 0.807 . . . . 0.0 110.94 176.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 20.7 t80 -57.09 -53.97 52.1 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 121.726 -0.608 . . . . 0.0 109.842 174.223 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 60.2 mt -62.98 -38.27 90.45 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.979 0.419 . . . . 0.0 111.893 179.113 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.65 -43.51 84.99 Favored Glycine 0 CA--C 1.522 0.508 0 N-CA-C 110.0 -1.24 . . . . 0.0 110.0 -178.414 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.74 -48.31 82.37 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 117.553 0.676 . . . . 0.0 109.881 173.438 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 9.1 tp -50.39 -57.7 7.37 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 121.429 0.633 . . . . 0.0 110.054 175.426 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.5 -56.64 10.71 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 124.877 1.271 . . . . 0.0 110.433 179.018 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 43.8 ttm -52.57 -49.66 64.51 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 125.555 1.542 . . . . 0.0 110.665 -179.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 58.3 mt -69.84 -50.02 52.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-O 117.894 -1.051 . . . . 0.0 110.262 -172.503 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.451 1.2 p90 -76.52 -37.93 55.94 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 120.166 1.348 . . . . 0.0 113.381 -178.573 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -81.29 67.4 7.21 Favored 'General case' 0 N--CA 1.463 0.203 0 O-C-N 121.102 -0.999 . . . . 0.0 108.692 173.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -41.54 -42.03 2.29 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.259 1.424 . . . . 0.0 111.464 179.303 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.5 -47.67 0.23 Allowed 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 126.192 1.797 . . . . 0.0 113.575 172.063 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 47.7 mt -56.1 -51.75 66.77 Favored 'General case' 0 N--CA 1.457 -0.082 0 C-N-CA 122.807 0.443 . . . . 0.0 110.832 178.431 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -63.55 -43.98 95.5 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 179.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.159 0 CA-C-O 117.257 -1.857 . . . . 0.0 110.466 169.838 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.473 0.676 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -71.57 78.22 0.8 Allowed 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 122.72 0.408 . . . . 0.0 110.533 -179.129 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.1 m -51.13 157.62 1.46 Allowed Pre-proline 0 CA--C 1.538 0.488 0 C-N-CA 125.031 1.332 . . . . 0.0 111.427 176.272 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_exo -46.45 -49.64 11.53 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 123.28 2.653 . . . . 0.0 112.929 -179.188 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.0 mt -58.54 -45.78 88.17 Favored 'General case' 0 C--O 1.225 -0.217 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 175.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -61.34 -43.26 99.16 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-N 118.3 0.5 . . . . 0.0 109.656 -177.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -60.71 -49.78 76.13 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.518 0.727 . . . . 0.0 110.573 176.413 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.47 -45.89 90.96 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.276 0.63 . . . . 0.0 111.388 -178.349 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 65.5 mt -53.78 -51.64 42.29 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 170.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.73 -48.84 17.59 Favored Glycine 0 CA--C 1.527 0.81 0 C-N-CA 124.733 1.159 . . . . 0.0 112.013 174.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.1 mt -55.51 -56.49 19.66 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 117.749 0.775 . . . . 0.0 111.062 174.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.23 -42.74 86.97 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 118.586 0.63 . . . . 0.0 111.451 -178.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 79.0 mt -58.24 -52.34 60.03 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 C-N-CA 123.578 0.751 . . . . 0.0 110.586 173.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.72 -50.65 59.7 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.069 -1.212 . . . . 0.0 110.069 -178.378 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 8.6 mm -52.94 -48.82 50.98 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 C-N-CA 123.306 0.642 . . . . 0.0 110.093 175.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -55.57 -59.01 5.43 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 120.71 0.291 . . . . 0.0 110.527 177.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 5.6 t-80 -55.36 -39.83 70.55 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 124.252 1.021 . . . . 0.0 111.061 -175.544 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -48.25 -34.49 10.39 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.653 0.781 . . . . 0.0 112.064 -178.37 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -107.16 -53.59 2.59 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.41 0.684 . . . . 0.0 109.793 178.1 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.8 m -60.68 -39.31 87.97 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.894 0.878 . . . . 0.0 112.267 -172.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.15 55.6 3.59 Favored Glycine 0 CA--C 1.526 0.724 0 C-N-CA 123.803 0.716 . . . . 0.0 112.066 -171.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.0 mtmp? -150.07 -45.17 0.13 Allowed 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 125.955 1.702 . . . . 0.0 110.614 -176.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -75.18 42.38 0.19 Allowed 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 114.373 1.249 . . . . 0.0 114.373 -169.133 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 69.57 -71.21 0.51 Allowed Glycine 0 CA--C 1.528 0.858 0 N-CA-C 110.623 -0.991 . . . . 0.0 110.623 -177.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 66.2 t0 -78.09 81.22 4.49 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 173.145 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.3 mtpp -46.9 -27.46 1.26 Allowed 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.472 1.509 . . . . 0.0 112.99 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 4.8 m80 -82.34 -5.18 58.43 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.62 1.568 . . . . 0.0 112.445 -171.469 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 6.9 p -126.91 164.5 21.31 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.753 1.221 . . . . 0.0 110.84 -178.694 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -154.44 174.63 14.62 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 124.342 1.057 . . . . 0.0 109.258 169.608 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.6 p -127.0 168.06 15.06 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.52 1.128 . . . . 0.0 112.831 -171.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.3 pttp -32.26 -61.34 0.26 Allowed 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 127.515 2.326 . . . . 0.0 113.921 177.47 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 20.5 tptp -54.66 -47.25 73.78 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 121.881 -0.512 . . . . 0.0 111.368 -179.27 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -61.81 -40.99 97.19 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 119.183 -0.437 . . . . 0.0 109.932 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 26.2 mt -63.13 -48.38 78.72 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 118.264 0.484 . . . . 0.0 111.437 176.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 9.1 mtpm? -61.93 -36.55 81.7 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.291 0.636 . . . . 0.0 110.966 179.193 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.58 -54.22 30.96 Favored 'General case' 0 C--O 1.224 -0.262 0 O-C-N 122.103 -0.373 . . . . 0.0 110.656 169.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.1 mt -43.77 -71.93 0.07 Allowed 'General case' 0 C--O 1.227 -0.108 0 C-N-CA 124.638 1.175 . . . . 0.0 110.29 178.288 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 12.9 tt -50.72 -50.66 22.26 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 CA-C-O 121.777 0.799 . . . . 0.0 110.212 -170.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -53.9 -47.13 71.45 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 126.324 1.85 . . . . 0.0 111.87 177.657 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.26 -55.37 5.78 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.944 0.498 . . . . 0.0 110.658 -175.668 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . 0.261 0.0 OUTLIER -91.27 -7.58 50.75 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 114.898 1.444 . . . . 0.0 114.898 -168.587 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 62.5 mt -118.18 81.49 1.68 Allowed 'General case' 0 C--O 1.231 0.109 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 167.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 57.9 p -76.47 61.85 1.79 Allowed 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 125.017 1.327 . . . . 0.0 108.667 179.33 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 66.2 mt -85.57 -58.8 3.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 C-N-CA 124.522 1.129 . . . . 0.0 108.06 -176.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.67 -67.63 1.61 Allowed Glycine 0 CA--C 1.528 0.848 0 N-CA-C 110.842 -0.903 . . . . 0.0 110.842 179.369 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 27.8 p -70.61 78.52 0.59 Allowed 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 169.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 42.7 mttp -54.91 95.87 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.758 1.223 . . . . 0.0 111.422 -172.27 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 57.1 mt -31.46 -53.94 0.24 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 127.6 2.36 . . . . 0.0 114.117 -172.542 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -153.46 169.85 22.17 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 106.53 -1.655 . . . . 0.0 106.53 175.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -40.15 -36.46 0.5 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 127.25 2.22 . . . . 0.0 113.009 -175.251 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -28.53 -57.53 0.13 Allowed 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 126.909 2.083 . . . . 0.0 113.89 178.025 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 63.4 tt0 -66.84 -40.99 88.15 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 121.075 0.464 . . . . 0.0 110.901 -173.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 1.8 mp -64.8 -51.24 69.6 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 -179.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 82.8 t -55.68 -43.06 72.03 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 C-N-CA 123.964 0.906 . . . . 0.0 110.098 177.559 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.27 -52.2 66.69 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 119.583 1.083 . . . . 0.0 111.003 174.673 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 37.5 mt -53.36 -41.44 65.84 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 119.491 -0.29 . . . . 0.0 111.401 179.156 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.5 -62.4 1.42 Allowed 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.399 0.545 . . . . 0.0 110.139 176.43 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -43.53 -39.98 3.7 Favored 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 126.996 2.118 . . . . 0.0 111.572 -177.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -39.0 -49.7 1.72 Allowed 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 124.165 0.986 . . . . 0.0 112.261 173.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.4 mp -60.84 -48.37 82.12 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 -177.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -61.29 -54.0 49.58 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.095 0.558 . . . . 0.0 109.73 179.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.6 ttm180 -49.13 -44.95 42.96 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.599 1.16 . . . . 0.0 110.219 178.02 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 11.7 m-80 -80.69 19.43 0.83 Allowed 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 113.508 0.929 . . . . 0.0 113.508 -178.299 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.3 mtmp? -58.46 -32.99 69.25 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 120.004 1.274 . . . . 0.0 107.936 165.268 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -70.8 8.22 0.94 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.931 1.292 . . . . 0.0 113.24 171.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 71.74 -53.68 0.68 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 127.397 2.279 . . . . 0.0 112.877 178.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -125.11 168.98 12.63 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 125.213 1.405 . . . . 0.0 109.984 179.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.7 m -132.0 151.1 34.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 C-N-CA 125.791 1.636 . . . . 0.0 106.976 169.269 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -90.31 170.94 9.83 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 123.321 0.648 . . . . 0.0 111.037 175.253 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 73.6 t80 -34.51 -63.89 0.28 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.987 1.315 . . . . 0.0 113.123 171.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 50.3 tp60 -63.26 -32.34 73.73 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.768 1.167 . . . . 0.0 111.496 -173.064 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -68.45 -41.2 80.61 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 121.262 -0.899 . . . . 0.0 110.246 176.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -56.58 -50.54 71.64 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 170.994 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.6 mm -56.28 -38.3 54.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 O-C-N 121.848 -0.533 . . . . 0.0 110.087 176.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 90.4 m -66.63 -38.24 86.5 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 121.465 -0.772 . . . . 0.0 111.035 175.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -54.85 -54.49 41.68 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 172.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 53.8 mt -59.95 -40.89 90.56 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 111.763 0.283 . . . . 0.0 111.763 176.272 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.07 -47.05 91.8 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 110.895 -0.882 . . . . 0.0 110.895 -177.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.32 -45.21 81.09 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.37 0.668 . . . . 0.0 109.948 177.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 59.0 tp -49.53 -58.67 4.76 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.369 0.604 . . . . 0.0 109.983 173.573 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -48.59 -58.57 4.51 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 124.46 1.104 . . . . 0.0 110.294 176.006 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 56.5 ttm -50.89 -57.52 8.29 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 122.994 0.518 . . . . 0.0 110.883 -178.158 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 31.6 mt -61.04 -38.33 79.31 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 CA-C-O 117.937 -1.03 . . . . 0.0 110.91 -172.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.382 0.0 OUTLIER -97.05 7.65 46.19 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 115.229 1.566 . . . . 0.0 115.229 176.704 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -122.99 87.71 2.8 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 119.596 1.089 . . . . 0.0 109.883 169.229 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -38.48 -42.39 0.75 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 126.041 1.737 . . . . 0.0 113.796 176.173 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -45.93 -46.32 16.04 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.385 0.674 . . . . 0.0 111.625 176.571 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 91.6 mt -73.7 4.03 5.62 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.618 0.767 . . . . 0.0 112.97 -177.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -116.45 10.87 14.73 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.596 1.159 . . . . 0.0 110.145 170.462 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.245 0 CA-C-O 117.009 -1.995 . . . . 0.0 110.891 -179.757 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 72.3 mtp . . . . . 0 N--CA 1.476 0.839 0 N-CA-C 110.476 -0.194 . . . . 0.0 110.476 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.43 70.55 3.83 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-O 121.174 0.511 . . . . 0.0 110.112 176.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.4 m -56.17 164.17 1.99 Allowed Pre-proline 0 CA--C 1.54 0.558 0 C-N-CA 124.256 1.023 . . . . 0.0 111.339 174.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo -47.56 -50.52 11.29 Favored 'Trans proline' 0 N--CA 1.458 -0.602 0 C-N-CA 123.013 2.475 . . . . 0.0 112.72 177.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 1.7 mt -60.52 -39.68 88.66 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-O 118.887 -0.578 . . . . 0.0 112.423 174.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -61.11 -45.88 92.86 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 119.291 0.951 . . . . 0.0 109.152 -179.304 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.9 tp60 -63.81 -43.92 94.81 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.717 -0.22 . . . . 0.0 111.081 177.106 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.31 -46.76 75.8 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.741 -0.599 . . . . 0.0 111.408 -177.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 76.7 mt -55.3 -52.16 48.53 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 170.268 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -45.19 -47.33 10.56 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 124.897 1.237 . . . . 0.0 111.906 174.803 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.5 mt -56.36 -59.01 5.58 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.442 0.697 . . . . 0.0 110.518 173.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.6 mp -57.25 -42.35 81.37 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 119.496 1.044 . . . . 0.0 112.061 -177.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 55.9 mt -58.77 -56.82 14.23 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 123.953 0.901 . . . . 0.0 110.439 174.168 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.06 -49.14 69.06 Favored Glycine 0 CA--C 1.522 0.513 0 N-CA-C 110.193 -1.163 . . . . 0.0 110.193 -176.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 8.5 mm -50.48 -53.51 12.26 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 C-N-CA 124.393 1.077 . . . . 0.0 109.99 174.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -52.64 -62.98 1.3 Allowed 'General case' 0 CA--C 1.528 0.117 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 177.079 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -51.03 -39.52 56.08 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.92 0.888 . . . . 0.0 111.745 -175.066 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -52.22 -34.82 47.38 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.969 0.907 . . . . 0.0 111.982 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 94.6 m-85 -111.42 -35.61 5.77 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 118.3 0.5 . . . . 0.0 112.18 -177.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.6 m -64.91 -37.41 87.54 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 119.028 0.831 . . . . 0.0 111.003 174.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.52 58.79 2.47 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 124.099 0.857 . . . . 0.0 112.984 -174.073 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 22.1 pttm -161.41 -37.25 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.845 1.258 . . . . 0.0 111.577 171.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -112.49 148.04 35.27 Favored 'General case' 0 C--N 1.339 0.15 0 C-N-CA 123.426 0.69 . . . . 0.0 111.497 -175.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 54.61 -145.61 27.87 Favored Glycine 0 CA--C 1.528 0.877 0 C-N-CA 124.452 1.025 . . . . 0.0 113.676 169.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -80.23 103.12 9.88 Favored 'General case' 0 C--O 1.223 -0.309 0 N-CA-C 106.99 -1.485 . . . . 0.0 106.99 175.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 40.7 mmtm -45.04 -35.4 2.96 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 116.324 1.972 . . . . 0.0 116.324 -168.084 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 38.8 p-80 -79.71 8.57 6.39 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 120.061 1.3 . . . . 0.0 113.798 177.129 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 17.0 p -135.72 171.93 13.75 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 126.79 2.036 . . . . 0.0 106.352 174.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.91 168.58 24.33 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 118.756 0.707 . . . . 0.0 110.485 173.836 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.4 t -116.25 -178.57 3.44 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.341 1.056 . . . . 0.0 112.256 -175.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 55.0 mttm -35.68 -66.61 0.19 Allowed 'General case' 0 C--O 1.234 0.285 0 C-N-CA 128.312 2.645 . . . . 0.0 113.235 -169.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 22.5 ttpp -50.82 -43.43 58.95 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.304 1.042 . . . . 0.0 110.589 -174.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -64.68 -35.61 81.6 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-O 118.723 -0.656 . . . . 0.0 111.602 -177.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -68.79 -51.38 41.57 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 119.502 1.047 . . . . 0.0 109.43 176.063 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -57.52 -42.35 82.68 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 120.996 0.427 . . . . 0.0 109.965 -178.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 55.9 tt0 -55.88 -65.66 0.56 Allowed 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 123.998 0.919 . . . . 0.0 109.233 169.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 4.9 mt -37.66 -60.65 0.69 Allowed 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 124.864 1.265 . . . . 0.0 112.003 179.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 18.3 tt -61.12 -48.53 88.59 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 -176.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 -56.5 -50.47 71.69 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.807 0.73 . . . . 0.0 112.063 179.284 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -70.35 -50.98 33.36 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.231 0.612 . . . . 0.0 110.695 -174.123 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -96.38 -17.83 20.36 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 -167.309 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 45.3 mt -113.91 70.95 0.74 Allowed 'General case' 0 CA--C 1.526 0.039 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 169.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 20.7 p -60.09 -40.53 89.9 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.484 171.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . 0.27 2.2 tt 65.21 -44.3 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 129.391 3.076 . . . . 0.0 116.504 169.224 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 114.95 -137.06 13.66 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 107.003 -2.439 . . . . 0.0 107.003 -169.387 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 4.0 m -76.65 54.79 0.99 Allowed 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 117.82 0.81 . . . . 0.0 113.096 -173.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 33.9 mtmm 41.38 67.32 0.56 Allowed 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.418 1.487 . . . . 0.0 111.37 178.535 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 16.1 mt -62.38 86.46 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.948 0.899 . . . . 0.0 112.741 -169.32 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 83.5 150.09 0.08 Allowed 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 127.445 2.298 . . . . 0.0 110.611 173.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -45.68 -36.85 5.2 Favored 'General case' 0 C--O 1.225 -0.227 0 C-N-CA 126.303 1.841 . . . . 0.0 113.511 -170.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.93 -60.24 0.17 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 126.108 1.763 . . . . 0.0 113.909 -179.317 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -63.57 -44.19 94.82 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.553 0.741 . . . . 0.0 110.843 -174.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.4 mp -62.06 -52.38 61.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 -177.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 75.6 t -53.86 -53.6 25.85 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 C-N-CA 123.961 0.905 . . . . 0.0 109.319 177.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -47.28 -52.5 16.01 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 118.698 0.681 . . . . 0.0 111.81 178.605 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 16.7 mt -50.57 -39.32 49.18 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 119.269 -0.396 . . . . 0.0 111.923 178.479 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 8.7 mmt -81.0 -64.72 1.13 Allowed 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 118.458 0.572 . . . . 0.0 109.737 178.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -34.82 -43.8 0.2 Allowed 'General case' 0 CA--C 1.523 -0.067 0 C-N-CA 128.046 2.538 . . . . 0.0 112.069 178.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -37.41 -50.95 1.1 Allowed 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.61 1.164 . . . . 0.0 112.577 176.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.8 pp -60.49 -33.13 72.16 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -173.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -83.54 -45.65 13.32 Favored 'General case' 0 N--CA 1.456 -0.125 0 C-N-CA 123.516 0.727 . . . . 0.0 109.746 176.764 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 52.8 ttt-85 -58.16 -37.14 74.11 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 122.178 -0.326 . . . . 0.0 110.955 -176.9 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -75.04 36.78 0.11 Allowed 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.478 -0.764 . . . . 0.0 112.357 177.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 63.6 mttt -63.02 -28.27 69.98 Favored 'General case' 0 CA--C 1.533 0.304 0 O-C-N 120.581 -1.324 . . . . 0.0 109.148 168.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -61.63 -13.32 21.29 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.104 0.961 . . . . 0.0 112.527 169.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 70.42 -63.53 0.4 Allowed 'General case' 0 C--N 1.342 0.247 0 C-N-CA 126.733 2.013 . . . . 0.0 110.649 -174.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -104.59 108.55 20.05 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.864 1.266 . . . . 0.0 107.642 172.677 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 28.4 m -79.58 136.08 24.31 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 N-CA-C 107.829 -1.175 . . . . 0.0 107.829 169.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 1.1 p30 -80.65 171.47 14.98 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.774 0.321 . . . . 0.0 111.186 176.682 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 55.9 t80 -38.12 -61.92 0.62 Allowed 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.401 1.08 . . . . 0.0 112.97 174.023 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 10.2 tp-100 -63.98 -32.52 74.09 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 120.391 1.45 . . . . 0.0 111.694 -175.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -64.52 -41.72 96.21 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 119.623 1.101 . . . . 0.0 110.162 175.15 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -57.95 -48.67 79.26 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.794 -0.566 . . . . 0.0 109.796 171.572 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 19.7 mm -60.83 -27.77 41.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 O-C-N 121.532 -0.73 . . . . 0.0 110.745 176.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 42.5 m -73.34 -38.69 65.67 Favored 'General case' 0 C--O 1.226 -0.181 0 O-C-N 121.076 -1.015 . . . . 0.0 110.171 172.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 36.6 t80 -54.33 -54.76 36.01 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 171.175 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 32.8 mt -59.9 -47.65 84.88 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 177.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.69 -39.83 97.93 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 111.021 -0.831 . . . . 0.0 111.021 -174.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.69 -47.85 57.74 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 123.882 0.873 . . . . 0.0 110.22 176.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -47.58 -53.74 13.72 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 123.933 0.893 . . . . 0.0 109.565 173.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -55.12 -56.31 21.25 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 124.259 1.024 . . . . 0.0 110.365 174.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 51.5 ttm -50.55 -42.95 55.96 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.516 0.598 . . . . 0.0 111.763 -178.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 42.8 mt -67.88 -58.39 6.24 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.442 0 CA-C-O 118.385 -0.817 . . . . 0.0 110.644 -179.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.364 1.0 OUTLIER -77.42 -38.39 49.79 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 119.94 1.246 . . . . 0.0 113.385 -174.674 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -78.75 64.86 3.84 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 170.295 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 60.0 mt-10 -46.91 -31.29 3.03 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 125.702 1.601 . . . . 0.0 112.802 -174.082 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -45.48 -36.92 4.79 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.06 0.944 . . . . 0.0 112.767 175.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 83.8 mt -62.95 -27.04 69.12 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 178.267 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -85.34 -48.61 8.88 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 118.539 0.609 . . . . 0.0 109.379 169.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.159 0 CA-C-O 117.534 -1.703 . . . . 0.0 110.086 -179.144 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 tmt? . . . . . 0 N--CA 1.474 0.736 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.58 73.09 4.15 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 122.744 0.418 . . . . 0.0 111.214 -174.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 2.7 m -54.51 161.71 1.99 Allowed Pre-proline 0 CA--C 1.538 0.518 0 C-N-CA 123.829 0.852 . . . . 0.0 111.193 173.213 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_exo -45.57 -49.08 11.08 Favored 'Trans proline' 0 N--CA 1.46 -0.453 0 C-N-CA 123.519 2.813 . . . . 0.0 113.573 -179.39 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.8 mt -55.62 -52.93 62.12 Favored 'General case' 0 C--O 1.226 -0.168 0 N-CA-C 111.769 0.285 . . . . 0.0 111.769 174.328 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -60.24 -41.44 93.14 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 -175.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.0 tp-100 -60.98 -51.08 70.76 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.57 0.748 . . . . 0.0 110.493 176.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.99 -45.81 93.31 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.338 0.655 . . . . 0.0 111.146 -178.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 67.2 mt -53.59 -52.16 36.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 170.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.69 -47.74 23.88 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 125.369 1.462 . . . . 0.0 111.601 175.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 mt -55.98 -54.59 42.96 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 117.726 0.763 . . . . 0.0 110.995 174.443 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.99 -43.93 91.53 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 118.87 0.759 . . . . 0.0 111.558 -179.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 96.2 mt -58.05 -49.29 81.9 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 123.007 0.523 . . . . 0.0 110.173 173.546 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.75 -51.54 54.4 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 110.102 -1.199 . . . . 0.0 110.102 -178.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 8.2 mm -54.81 -49.35 70.05 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 123.273 0.629 . . . . 0.0 109.745 175.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -53.48 -55.67 23.36 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 121.479 0.657 . . . . 0.0 110.985 178.077 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 74.2 t60 -64.79 -32.39 74.05 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.346 -175.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -53.11 -49.65 66.07 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.882 0.764 . . . . 0.0 110.712 176.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -89.96 -36.04 15.21 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 122.323 -0.236 . . . . 0.0 111.321 -175.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.3 t -63.62 -31.64 72.87 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.775 -0.578 . . . . 0.0 110.641 173.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -39.88 -37.19 0.92 Allowed Glycine 0 CA--C 1.525 0.701 0 C-N-CA 128.296 2.855 . . . . 0.0 115.334 -176.025 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -77.84 -20.33 53.3 Favored 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 -176.282 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -82.23 173.45 12.08 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.486 0.714 . . . . 0.0 110.43 -176.407 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -65.86 -60.63 6.29 Favored Glycine 0 CA--C 1.53 0.989 0 N-CA-C 110.411 -1.075 . . . . 0.0 110.411 178.167 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -84.84 90.51 7.79 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 176.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 59.9 mttm -76.1 37.24 0.15 Allowed 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.517 1.127 . . . . 0.0 113.568 -169.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 4.6 p80 -150.63 38.44 0.69 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 126.214 1.805 . . . . 0.0 108.562 172.337 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -161.41 141.58 10.7 Favored 'General case' 0 N--CA 1.455 -0.206 0 N-CA-C 105.694 -1.965 . . . . 0.0 105.694 -177.323 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -160.01 174.82 13.78 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 119.008 0.822 . . . . 0.0 110.661 -176.79 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 59.6 p -124.57 174.38 7.86 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 118.808 0.731 . . . . 0.0 112.579 -170.025 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -27.39 -53.47 0.08 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 128.348 2.659 . . . . 0.0 114.016 169.664 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.07 -54.77 40.98 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.805 0.842 . . . . 0.0 109.713 179.724 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 -66.11 -34.34 77.83 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 118.642 -0.694 . . . . 0.0 110.527 -177.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 60.2 mt -65.13 -50.06 67.51 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.317 0.962 . . . . 0.0 110.999 177.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 40.7 mttp -57.19 -49.16 76.83 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 174.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -53.09 -54.73 31.26 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.644 0.778 . . . . 0.0 110.302 177.006 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.6 mt -48.42 -65.29 0.59 Allowed 'General case' 0 CA--C 1.52 -0.196 0 C-N-CA 126.099 1.759 . . . . 0.0 110.171 177.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 16.9 tt -59.89 -44.76 95.03 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.275 0 N-CA-C 109.543 -0.539 . . . . 0.0 109.543 -171.442 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -60.16 -53.51 56.93 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 179.364 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -67.82 -49.19 63.58 Favored 'General case' 0 C--O 1.227 -0.083 0 O-C-N 121.825 -0.547 . . . . 0.0 109.576 -174.133 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -74.63 -65.05 0.91 Allowed 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -175.767 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 89.3 mt -88.42 67.26 8.57 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 -178.068 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 38.8 p -47.99 -65.04 0.63 Allowed 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 124.366 1.066 . . . . 0.0 109.838 177.156 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 48.8 mt 64.8 -64.39 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 C-N-CA 127.205 2.202 . . . . 0.0 111.978 173.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.36 -66.09 1.97 Allowed Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.066 -1.214 . . . . 0.0 110.066 -178.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 21.0 m -68.29 75.54 0.24 Allowed 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 124.373 1.069 . . . . 0.0 109.223 170.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 23.4 mmtp -47.45 93.89 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 126.032 1.733 . . . . 0.0 110.825 -179.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 87.9 mt -46.31 -54.55 8.73 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 125.637 1.575 . . . . 0.0 112.982 -169.542 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -166.72 162.07 16.02 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 106.158 -1.793 . . . . 0.0 106.158 -169.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -38.09 -40.8 0.52 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 126.643 1.977 . . . . 0.0 114.773 -171.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.86 -59.56 0.17 Allowed 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.796 1.639 . . . . 0.0 114.66 -178.237 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 17.6 tt0 -65.57 -40.27 92.58 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-O 121.13 0.491 . . . . 0.0 111.214 -174.265 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 2.2 mp -63.83 -51.86 64.36 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 -179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 69.2 t -55.13 -43.7 71.34 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 C-N-CA 124.401 1.081 . . . . 0.0 110.348 178.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.34 -54.41 45.78 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 119.205 0.911 . . . . 0.0 110.454 173.89 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 57.5 mt -54.18 -40.02 67.15 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 119.267 -0.397 . . . . 0.0 111.2 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 25.3 mmt -68.62 -65.01 0.75 Allowed 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.549 0.613 . . . . 0.0 109.711 175.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -40.69 -40.46 1.31 Allowed 'General case' 0 N--CA 1.462 0.171 0 C-N-CA 128.077 2.551 . . . . 0.0 111.886 -177.572 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -38.43 -48.55 1.38 Allowed 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 124.479 1.112 . . . . 0.0 111.876 175.284 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -61.33 -38.29 86.37 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 118.393 0.542 . . . . 0.0 111.838 -176.551 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -76.15 -51.19 12.68 Favored 'General case' 0 N--CA 1.457 -0.106 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 16.9 ttm180 -48.51 -46.85 38.98 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 123.571 0.748 . . . . 0.0 109.926 177.215 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -86.23 29.06 0.77 Allowed 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -177.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 20.0 pttp -57.46 -35.73 70.51 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.157 -0.965 . . . . 0.0 108.84 166.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -74.29 3.7 6.9 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.938 1.295 . . . . 0.0 112.623 173.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 79.1 mm-40 68.72 -63.61 0.35 Allowed 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 127.017 2.127 . . . . 0.0 112.054 -178.211 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -97.63 162.06 13.47 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.983 0.913 . . . . 0.0 109.844 177.111 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.4 m -137.38 149.65 25.79 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 C-N-CA 126.044 1.738 . . . . 0.0 108.079 174.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -89.49 175.71 7.19 Favored 'General case' 0 C--N 1.339 0.142 0 C-N-CA 124.285 1.034 . . . . 0.0 111.108 176.989 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -39.46 -64.74 0.44 Allowed 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 125.275 1.43 . . . . 0.0 112.967 174.483 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 11.0 tp-100 -65.03 -32.22 73.83 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 120.242 1.383 . . . . 0.0 111.807 -172.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -65.22 -44.47 88.15 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 119.033 0.833 . . . . 0.0 110.419 175.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -55.92 -54.31 46.28 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 172.279 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 20.7 mm -52.06 -46.37 42.63 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.312 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 178.419 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 92.9 m -59.35 -27.8 66.26 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 123.464 0.706 . . . . 0.0 111.795 179.084 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 11.4 t80 -59.69 -52.13 66.84 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 119.464 1.029 . . . . 0.0 108.436 172.166 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 56.2 mt -67.26 -40.05 86.15 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.853 0.861 . . . . 0.0 111.699 -179.538 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.51 -45.12 69.38 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.135 -1.186 . . . . 0.0 110.135 -178.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.02 -48.58 81.13 Favored 'General case' 0 N--CA 1.451 -0.387 0 O-C-N 122.279 -0.541 . . . . 0.0 109.796 173.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 22.5 tp -50.44 -57.03 8.97 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.407 0.622 . . . . 0.0 109.807 176.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.1 -55.04 16.57 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 124.56 1.144 . . . . 0.0 110.247 177.294 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 7.7 ttp -59.82 -45.07 93.53 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 122.925 0.49 . . . . 0.0 111.516 -175.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 93.0 mt -64.63 -52.94 48.4 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 CA-C-O 117.995 -1.002 . . . . 0.0 110.281 -177.874 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.445 0.0 OUTLIER -79.3 -34.06 42.73 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 120.034 1.288 . . . . 0.0 113.887 -176.121 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -80.1 72.93 6.92 Favored 'General case' 0 N--CA 1.462 0.164 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 169.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -47.79 -30.48 4.01 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.956 1.302 . . . . 0.0 113.097 -171.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -38.79 -47.02 1.34 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.959 1.304 . . . . 0.0 112.39 169.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.4 mt -72.49 6.54 2.31 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -177.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -106.61 8.22 31.09 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 119.507 1.049 . . . . 0.0 109.908 167.386 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.116 0 CA-C-O 117.384 -1.787 . . . . 0.0 108.846 171.573 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 61.9 ttp . . . . . 0 N--CA 1.474 0.754 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -79.25 63.2 3.82 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 121.249 0.547 . . . . 0.0 110.378 176.772 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 2.5 m -59.63 166.41 3.33 Favored Pre-proline 0 CA--C 1.539 0.549 0 C-N-CA 125.134 1.374 . . . . 0.0 111.202 178.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_exo -45.75 -47.26 14.05 Favored 'Trans proline' 0 N--CA 1.459 -0.5 0 C-N-CA 123.257 2.638 . . . . 0.0 112.927 177.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 6.2 mt -56.67 -49.23 75.69 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 119.329 -0.367 . . . . 0.0 111.514 174.249 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -58.21 -46.74 85.31 Favored 'General case' 0 N--CA 1.457 -0.124 0 CA-C-N 118.488 0.585 . . . . 0.0 109.853 -178.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 -57.54 -51.0 71.25 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 122.759 0.424 . . . . 0.0 110.575 177.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.5 -45.7 82.55 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.49 0.716 . . . . 0.0 111.867 -175.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 81.7 mt -55.88 -50.08 70.97 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 172.002 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.37 -50.39 17.84 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 124.886 1.231 . . . . 0.0 111.5 173.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.1 mt -54.24 -57.59 10.59 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 117.474 0.637 . . . . 0.0 110.702 174.223 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 9.9 mp -57.42 -43.44 83.82 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 119.391 0.996 . . . . 0.0 112.032 -177.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 85.8 mt -56.97 -58.03 7.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 C-N-CA 123.171 0.588 . . . . 0.0 110.12 173.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.25 -49.5 67.86 Favored Glycine 0 CA--C 1.524 0.605 0 N-CA-C 110.553 -1.019 . . . . 0.0 110.553 -175.269 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.3 mm -49.68 -50.99 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 C-N-CA 124.139 0.976 . . . . 0.0 109.935 173.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 56.4 t80 -57.46 -58.94 6.1 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 121.042 0.449 . . . . 0.0 110.008 178.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 7.1 t-80 -51.55 -36.98 47.43 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.051 0.94 . . . . 0.0 111.626 -176.513 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -51.56 -34.04 34.97 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.298 1.039 . . . . 0.0 112.474 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -111.61 -47.41 3.16 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 118.6 0.636 . . . . 0.0 110.688 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.2 m -72.42 -42.65 64.87 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.266 0.626 . . . . 0.0 111.963 -176.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -80.41 66.36 3.68 Favored Glycine 0 N--CA 1.446 -0.646 0 CA-C-N 116.097 -0.501 . . . . 0.0 112.177 -167.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 5.9 mtmp? -89.04 -61.82 1.62 Allowed 'General case' 0 N--CA 1.445 -0.678 0 C-N-CA 123.858 0.863 . . . . 0.0 109.108 -178.23 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -169.02 168.99 9.83 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 125.612 1.565 . . . . 0.0 106.937 179.207 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 52.89 -106.56 0.41 Allowed Glycine 0 CA--C 1.528 0.871 0 C-N-CA 123.687 0.661 . . . . 0.0 112.053 174.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -79.98 55.94 2.25 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.178 0.991 . . . . 0.0 110.906 -175.454 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 38.9 mtmt -53.87 -27.96 33.27 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.902 0.881 . . . . 0.0 112.662 -177.947 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -78.33 6.52 8.15 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 114.109 1.152 . . . . 0.0 114.109 -175.328 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -138.85 151.91 47.38 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.078 1.351 . . . . 0.0 109.474 -170.201 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -156.09 166.38 33.62 Favored 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 123.26 0.624 . . . . 0.0 110.779 174.031 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 67.9 m -111.76 174.68 5.76 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.145 1.378 . . . . 0.0 112.818 -176.197 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -37.81 -55.38 1.19 Allowed 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 126.913 2.085 . . . . 0.0 114.545 -177.683 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -53.56 -48.51 69.08 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 -176.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -61.14 -38.65 87.16 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 123.041 0.536 . . . . 0.0 111.324 179.133 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 85.0 mt -63.27 -49.33 74.48 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 119.214 0.916 . . . . 0.0 111.038 175.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -57.56 -47.17 82.79 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 177.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -58.17 -47.41 83.49 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-O 119.024 -0.512 . . . . 0.0 110.791 175.232 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 8.9 mt -50.76 -53.58 30.56 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 119.655 1.116 . . . . 0.0 110.176 178.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 35.9 mt -56.78 -60.34 2.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.212 175.558 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 21.1 tt0 -53.07 -48.98 67.3 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.621 -0.674 . . . . 0.0 112.496 -173.476 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 9.5 mmpt? -79.53 -48.97 12.96 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 125.564 1.546 . . . . 0.0 110.551 -171.178 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 28.2 mm-40 -101.89 -12.42 18.26 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 -168.435 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 57.2 mt -116.33 72.33 0.81 Allowed 'General case' 0 C--O 1.231 0.102 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 169.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 73.4 p -77.9 49.97 0.82 Allowed 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 125.218 1.407 . . . . 0.0 109.414 178.191 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 36.3 mt -66.15 -43.45 92.07 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 C-N-CA 123.277 0.631 . . . . 0.0 109.71 -170.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.73 -65.98 1.75 Allowed Glycine 0 CA--C 1.528 0.892 0 N-CA-C 110.265 -1.134 . . . . 0.0 110.265 -176.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 17.7 m -68.45 72.55 0.21 Allowed 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 125.269 1.428 . . . . 0.0 110.327 174.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 30.9 mmtm -40.9 90.5 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 127.617 2.367 . . . . 0.0 112.665 179.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 86.1 mt -67.08 111.34 3.82 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.058 0.943 . . . . 0.0 112.667 -170.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 68.44 -69.28 0.15 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.154 1.781 . . . . 0.0 113.9 166.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 18.3 p-10 -178.33 -42.3 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 125.55 1.54 . . . . 0.0 110.282 -170.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.84 -63.57 0.13 Allowed 'General case' 0 C--O 1.226 -0.142 0 C-N-CA 126.198 1.799 . . . . 0.0 114.133 -174.242 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -66.17 -37.54 85.89 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 122.747 0.419 . . . . 0.0 111.32 -172.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.4 mp -62.28 -52.76 56.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 N-CA-C 106.076 -1.824 . . . . 0.0 106.076 177.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 71.9 t -54.04 -40.87 47.68 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 C-N-CA 124.23 1.012 . . . . 0.0 110.41 176.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 12.8 mmmt -60.94 -51.22 70.21 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 120.187 1.358 . . . . 0.0 110.484 175.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 76.3 mt -56.96 -36.41 70.26 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 119.148 -0.454 . . . . 0.0 110.906 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 25.2 mmt -70.26 -62.49 1.37 Allowed 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 118.739 0.699 . . . . 0.0 109.808 173.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -46.61 -30.47 2.31 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 128.132 2.573 . . . . 0.0 112.405 -176.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -38.29 -48.17 1.28 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.508 1.123 . . . . 0.0 111.268 169.181 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.9 pp -58.52 -34.32 70.83 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 121.144 -0.972 . . . . 0.0 112.167 -178.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -78.42 -55.95 4.82 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 178.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 16.5 mmt180 -42.11 -50.35 4.75 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 124.972 1.309 . . . . 0.0 110.646 176.371 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 25.5 m120 -94.81 25.02 4.3 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 123.971 0.908 . . . . 0.0 111.849 -171.456 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 7.4 mtmp? -55.92 -39.1 71.17 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 119.639 1.109 . . . . 0.0 109.355 168.152 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -80.5 13.02 2.67 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.931 0.892 . . . . 0.0 112.121 175.512 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 65.68 -68.03 0.13 Allowed 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 126.581 1.953 . . . . 0.0 111.43 -172.47 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -87.89 154.83 20.22 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 125.149 1.38 . . . . 0.0 111.309 -172.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 34.9 m -132.58 147.6 31.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 N-CA-C 105.618 -1.993 . . . . 0.0 105.618 165.713 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 20.2 p30 -89.24 171.6 9.67 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 123.556 0.742 . . . . 0.0 110.884 176.746 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -39.97 -60.85 0.95 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.568 1.147 . . . . 0.0 113.16 175.186 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -64.56 -35.99 82.78 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 120.314 1.416 . . . . 0.0 111.362 -174.167 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.77 -40.27 96.27 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.561 -0.712 . . . . 0.0 110.578 175.194 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -57.2 -49.68 75.25 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 118.571 0.623 . . . . 0.0 109.964 169.653 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 24.6 mm -58.62 -28.14 36.05 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 O-C-N 121.384 -0.822 . . . . 0.0 110.709 176.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 30.1 m -80.25 -23.48 40.79 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.231 1.012 . . . . 0.0 111.786 173.366 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -67.56 -53.48 28.0 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 107.673 -1.232 . . . . 0.0 107.673 169.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 40.9 mt -57.65 -41.65 81.91 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 120.908 0.385 . . . . 0.0 110.668 171.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.76 -53.1 46.53 Favored Glycine 0 CA--C 1.523 0.577 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 179.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.75 -47.31 85.8 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 122.83 0.452 . . . . 0.0 110.641 178.218 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 11.3 tp -48.06 -60.54 2.54 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.978 0.894 . . . . 0.0 110.082 175.155 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.85 -56.64 12.78 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 125.31 1.444 . . . . 0.0 110.294 -179.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 56.6 ttm -56.26 -43.42 78.71 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.737 0.815 . . . . 0.0 110.989 -178.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 96.4 mt -67.9 -55.74 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-O 118.415 -0.802 . . . . 0.0 109.533 -175.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.4 0.4 OUTLIER -73.13 -33.63 65.64 Favored 'General case' 0 C--N 1.344 0.356 0 C-N-CA 118.325 -1.35 . . . . 0.0 112.803 -175.982 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -81.14 64.98 6.1 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 169.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -42.22 -37.96 1.63 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.138 1.375 . . . . 0.0 112.747 -176.861 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.69 -54.0 0.44 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 126.093 1.757 . . . . 0.0 112.65 169.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 61.7 mt -63.49 -17.79 63.11 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -173.285 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -68.02 -27.97 67.0 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.676 0.671 . . . . 0.0 110.91 174.341 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.169 0 CA-C-O 117.167 -1.907 . . . . 0.0 110.921 -169.912 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.5 mtm . . . . . 0 N--CA 1.476 0.835 0 CA-C-O 120.25 0.071 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -75.77 71.03 2.6 Favored 'General case' 0 CA--C 1.529 0.137 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 173.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.4 m -56.01 163.79 2.07 Favored Pre-proline 0 CA--C 1.54 0.593 0 C-N-CA 124.204 1.002 . . . . 0.0 111.352 177.049 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -46.62 -49.02 12.71 Favored 'Trans proline' 0 N--CA 1.459 -0.528 0 C-N-CA 123.255 2.637 . . . . 0.0 112.831 178.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.2 mt -58.64 -46.39 87.22 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-O 119.193 -0.432 . . . . 0.0 111.543 175.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -56.97 -48.18 79.0 Favored 'General case' 0 C--O 1.227 -0.131 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 -179.025 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.3 tp60 -62.81 -44.44 96.14 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.275 179.146 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.4 -46.17 81.08 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 121.355 0.598 . . . . 0.0 111.328 -178.181 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 72.4 mt -54.55 -50.86 55.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 170.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.51 -48.98 16.48 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 124.646 1.117 . . . . 0.0 111.729 173.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 mt -55.36 -55.34 32.71 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 117.767 0.784 . . . . 0.0 110.945 174.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -58.91 -45.2 90.9 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 119.012 0.824 . . . . 0.0 111.839 -178.04 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 90.5 mt -59.5 -50.98 77.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 C-N-CA 122.857 0.463 . . . . 0.0 110.354 175.073 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -53.59 -54.07 32.3 Favored Glycine 0 CA--C 1.523 0.539 0 N-CA-C 109.763 -1.335 . . . . 0.0 109.763 -179.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 6.8 mm -50.53 -51.7 18.24 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 C-N-CA 124.079 0.952 . . . . 0.0 110.12 174.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -51.51 -57.25 9.57 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 118.022 0.374 . . . . 0.0 110.594 178.454 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -70.3 -21.7 62.91 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 -174.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.8 ttpp -57.93 -18.57 24.09 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 119.034 -0.508 . . . . 0.0 111.342 169.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -115.92 -67.72 0.97 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.743 0.817 . . . . 0.0 110.273 171.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 30.9 p -51.03 -65.92 0.47 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.714 0.769 . . . . 0.0 111.158 -173.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -34.19 -56.32 0.71 Allowed Glycine 0 CA--C 1.52 0.406 0 C-N-CA 128.465 2.936 . . . . 0.0 112.089 178.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -77.43 -37.92 50.67 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -177.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -76.78 48.11 0.55 Allowed 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 119.284 0.947 . . . . 0.0 112.492 -176.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 73.4 -67.12 1.55 Allowed Glycine 0 CA--C 1.529 0.966 0 O-C-N 121.299 -0.876 . . . . 0.0 113.558 169.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -80.15 57.74 2.8 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.298 1.039 . . . . 0.0 110.922 -171.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 28.8 mttp -35.41 -42.55 0.21 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 128.03 2.532 . . . . 0.0 117.453 -167.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 16.1 m170 -84.03 -7.65 59.34 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.848 0.859 . . . . 0.0 112.748 -174.103 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.3 p -138.35 173.39 11.66 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 126.876 2.071 . . . . 0.0 109.585 -168.216 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.7 pp -160.2 -173.86 4.24 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 169.384 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 77.8 p -129.95 172.84 11.28 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 119.697 1.135 . . . . 0.0 112.568 -179.582 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.7 ptmm? -31.69 -51.06 0.21 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 126.107 1.763 . . . . 0.0 113.512 169.491 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.7 ttpt -60.87 -47.53 85.98 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -177.241 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.0 mp0 -66.55 -35.44 80.23 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 118.428 -0.796 . . . . 0.0 110.559 179.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 73.7 mt -61.52 -51.38 68.85 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.779 1.172 . . . . 0.0 111.032 174.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.0 mtpp -60.11 -45.12 94.03 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 120.841 0.353 . . . . 0.0 110.279 179.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -54.52 -54.93 34.58 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.112 0.965 . . . . 0.0 110.521 173.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.0 mt -49.02 -61.19 2.2 Favored 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 125.382 1.473 . . . . 0.0 110.033 178.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 20.2 tt -59.71 -48.74 86.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 C-N-CA 119.872 -0.731 . . . . 0.0 109.724 -176.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 -54.88 -50.11 69.54 Favored 'General case' 0 CA--C 1.539 0.528 0 O-C-N 121.88 -0.512 . . . . 0.0 112.208 -178.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.7 -54.21 7.32 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 121.908 -0.495 . . . . 0.0 110.714 -176.862 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 49.8 mm-40 -82.4 -21.81 35.64 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 -167.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 23.0 mt -117.78 79.21 1.33 Allowed 'General case' 0 C--O 1.227 -0.086 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 174.437 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 34.1 p -65.98 -64.85 0.77 Allowed 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 -178.261 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . 0.26 45.6 mt 66.06 -60.53 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 126.695 1.998 . . . . 0.0 113.015 174.405 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.08 -67.07 1.79 Allowed Glycine 0 CA--C 1.526 0.768 0 N-CA-C 110.323 -1.111 . . . . 0.0 110.323 -179.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 56.0 m -70.03 79.16 0.49 Allowed 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 169.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 21.6 mmtm -55.21 83.63 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.913 1.685 . . . . 0.0 111.393 -178.123 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 75.4 mt -30.29 -58.24 0.19 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 128.155 2.582 . . . . 0.0 113.938 -172.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -162.84 162.7 26.58 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 106.506 -1.665 . . . . 0.0 106.506 -175.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -34.33 -42.91 0.15 Allowed 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 128.101 2.56 . . . . 0.0 114.505 -172.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.37 -60.91 0.14 Allowed 'General case' 0 C--O 1.226 -0.177 0 C-N-CA 125.874 1.67 . . . . 0.0 113.313 -176.331 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -64.56 -38.09 89.82 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -173.316 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 1.2 mp -61.64 -54.97 27.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 N-CA-C 106.159 -1.793 . . . . 0.0 106.159 176.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 79.1 t -51.49 -49.62 32.22 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.079 -178.298 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 6.4 mmmm -51.86 -47.61 64.37 Favored 'General case' 0 C--N 1.339 0.111 0 CA-C-N 119.59 1.086 . . . . 0.0 111.753 -176.567 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 32.9 mt -57.33 -35.61 70.1 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 119.283 -0.389 . . . . 0.0 111.543 -178.011 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.28 -62.87 1.55 Allowed 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 176.128 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -40.57 -40.36 1.24 Allowed 'General case' 0 CA--C 1.523 -0.094 0 C-N-CA 127.528 2.331 . . . . 0.0 111.877 -179.351 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -38.52 -47.57 1.3 Allowed 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.811 1.244 . . . . 0.0 112.009 175.715 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -57.6 -51.89 67.65 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 118.124 0.42 . . . . 0.0 110.713 -178.44 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -74.44 -31.38 62.26 Favored 'General case' 0 C--O 1.224 -0.262 0 C-N-CA 123.231 0.613 . . . . 0.0 111.383 -176.215 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.5 ttm180 -63.14 -53.86 46.8 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 173.315 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 -83.17 52.98 2.32 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 123.604 0.762 . . . . 0.0 110.096 -172.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 76.6 mttt -58.06 -41.92 84.35 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 108.733 -0.839 . . . . 0.0 108.733 172.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -67.5 -5.7 16.3 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.083 1.353 . . . . 0.0 113.163 175.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 66.8 mm-40 70.78 -57.79 0.58 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 126.456 1.902 . . . . 0.0 111.595 -175.17 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -87.2 156.75 19.54 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.572 1.549 . . . . 0.0 110.735 177.607 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 4.2 m -143.93 159.79 16.03 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 127.218 2.207 . . . . 0.0 107.87 174.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -101.04 170.92 7.95 Favored 'General case' 0 N--CA 1.462 0.157 0 C-N-CA 125.086 1.354 . . . . 0.0 110.964 175.812 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 73.9 t80 -35.12 -63.42 0.33 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.685 1.194 . . . . 0.0 112.945 171.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 28.9 tp60 -67.03 -29.04 68.74 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 119.633 1.106 . . . . 0.0 111.81 -171.939 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -65.72 -43.23 89.73 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.14 -0.975 . . . . 0.0 109.845 172.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -54.43 -49.29 70.33 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.985 -0.447 . . . . 0.0 109.91 170.611 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.8 mm -58.72 -33.53 49.29 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 O-C-N 121.6 -0.688 . . . . 0.0 110.732 175.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 32.3 m -70.52 -30.27 66.99 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.07 -1.019 . . . . 0.0 111.04 174.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -61.03 -55.45 32.65 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 121.096 -1.003 . . . . 0.0 109.169 170.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 44.3 mt -62.36 -40.25 95.8 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.118 0.485 . . . . 0.0 111.535 179.19 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.35 -43.69 96.49 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 110.643 -0.983 . . . . 0.0 110.643 179.617 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.39 -47.8 80.5 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 117.497 0.648 . . . . 0.0 110.444 175.628 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 20.3 tp -48.61 -58.98 3.89 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 121.402 0.62 . . . . 0.0 110.257 172.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -49.77 -54.18 20.58 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 124.381 1.073 . . . . 0.0 110.496 179.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 46.9 ttm -57.84 -49.78 75.51 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 123.809 0.844 . . . . 0.0 111.091 -178.316 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 67.0 mt -63.35 -49.56 82.37 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 CA-C-O 117.942 -1.028 . . . . 0.0 109.932 -174.13 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.451 0.1 OUTLIER -79.46 -37.66 36.4 Favored 'General case' 0 C--N 1.347 0.488 0 CA-C-N 119.733 1.151 . . . . 0.0 113.837 -178.258 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -80.72 75.12 7.64 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 107.691 -1.225 . . . . 0.0 107.691 171.043 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -47.66 -32.45 5.67 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.627 1.171 . . . . 0.0 112.684 -175.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -40.87 -38.87 1.02 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.673 1.189 . . . . 0.0 113.171 171.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 43.7 mt -91.1 12.89 18.47 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.939 1.296 . . . . 0.0 113.828 -173.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 19.3 mmtp -65.61 79.39 0.07 Allowed 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 120.14 1.336 . . . . 0.0 113.184 -173.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.16 0 CA-C-O 118.316 -1.269 . . . . 0.0 110.775 174.446 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 28.1 ttt . . . . . 0 N--CA 1.475 0.778 0 CA-C-O 120.494 0.188 . . . . 0.0 110.972 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -69.04 79.97 0.32 Allowed 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.854 0.461 . . . . 0.0 110.101 176.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -53.83 159.99 2.38 Favored Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 124.622 1.169 . . . . 0.0 111.248 176.74 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -47.52 -49.62 12.94 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 123.305 2.67 . . . . 0.0 112.806 179.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.2 mt -58.41 -43.88 88.79 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 119.094 -0.479 . . . . 0.0 111.788 174.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -62.86 -42.06 99.61 Favored 'General case' 0 C--O 1.226 -0.143 0 CA-C-N 119.045 0.838 . . . . 0.0 109.489 -177.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 12.8 tp60 -61.69 -46.75 88.37 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 122.39 0.276 . . . . 0.0 110.853 175.109 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.28 -46.8 82.09 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.645 0.736 . . . . 0.0 111.275 -177.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 74.8 mt -55.74 -50.92 64.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 171.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -48.49 -45.89 29.43 Favored Glycine 0 CA--C 1.527 0.787 0 C-N-CA 125.031 1.301 . . . . 0.0 111.468 175.372 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.8 mt -56.27 -57.45 12.18 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 117.613 0.707 . . . . 0.0 110.409 173.284 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -57.12 -43.4 82.32 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 119.371 0.987 . . . . 0.0 112.122 -178.225 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 97.2 mt -61.2 -54.08 40.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 123.151 0.58 . . . . 0.0 110.679 175.495 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.99 -51.23 55.16 Favored Glycine 0 CA--C 1.522 0.494 0 N-CA-C 109.666 -1.374 . . . . 0.0 109.666 -177.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 8.5 mm -48.04 -54.7 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 C-N-CA 124.279 1.032 . . . . 0.0 110.277 173.03 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -53.29 -62.15 1.84 Allowed 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 121.347 0.594 . . . . 0.0 110.257 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 54.7 t60 -72.63 -12.91 61.24 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 118.971 -0.538 . . . . 0.0 112.393 -170.812 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -54.96 -44.48 74.4 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.423 1.01 . . . . 0.0 108.778 169.093 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -94.15 73.07 3.99 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 104.9 -2.259 . . . . 0.0 104.9 171.122 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 85.1 p -60.58 69.37 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 127.227 2.211 . . . . 0.0 114.376 -167.678 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . 36.4 47.85 1.16 Allowed Glycine 0 CA--C 1.525 0.685 0 C-N-CA 126.981 2.229 . . . . 0.0 113.79 176.074 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 6.7 mtpm? -57.7 -36.11 71.52 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.74 0.816 . . . . 0.0 110.992 -169.725 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -78.92 2.03 21.59 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -178.163 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -171.02 -122.83 0.66 Allowed Glycine 0 C--N 1.339 0.698 0 CA-C-N 120.325 1.42 . . . . 0.0 111.861 177.156 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -79.22 149.85 31.78 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 172.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 10.4 mmpt? -68.11 0.9 3.17 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 -168.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 6.4 p-80 -123.28 23.37 9.11 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.433 1.093 . . . . 0.0 111.58 168.58 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 71.6 p -134.43 145.03 48.5 Favored 'General case' 0 C--O 1.227 -0.089 0 C-N-CA 124.921 1.288 . . . . 0.0 108.246 175.643 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -156.57 163.03 39.84 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-N 119.323 0.965 . . . . 0.0 110.69 -178.092 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 29.9 t -120.99 -168.65 1.7 Allowed 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.635 0.731 . . . . 0.0 110.944 -176.197 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 10.3 pttm -46.99 -50.98 18.22 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 126.893 2.077 . . . . 0.0 113.131 -171.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -55.48 -52.13 64.66 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 120.762 0.315 . . . . 0.0 110.294 -179.132 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -67.04 -35.66 80.37 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 118.436 -0.792 . . . . 0.0 111.8 -179.456 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 30.0 mt -64.03 -52.3 60.14 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 119.966 1.257 . . . . 0.0 111.149 175.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 90.4 mttt -56.38 -43.83 79.6 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 122.707 0.403 . . . . 0.0 110.044 177.317 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 65.7 tt0 -54.09 -66.45 0.39 Allowed 'General case' 0 C--O 1.223 -0.334 0 CA-C-O 118.895 -0.574 . . . . 0.0 109.523 171.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 3.8 mt -37.54 -60.09 0.72 Allowed 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 125.364 1.465 . . . . 0.0 111.565 179.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 14.3 tt -62.55 -45.2 99.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.265 -176.094 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 -57.34 -52.96 63.22 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 121.343 -0.848 . . . . 0.0 111.731 177.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 11.4 mmpt? -66.76 -49.29 66.4 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.059 0.544 . . . . 0.0 110.497 -174.562 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 70.1 mm-40 -98.06 -16.65 19.51 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 115.06 1.504 . . . . 0.0 115.06 -166.77 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 13.5 mt -118.36 79.78 1.43 Allowed 'General case' 0 CA--C 1.523 -0.088 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 171.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 65.7 p -79.13 51.22 1.14 Allowed 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.374 1.07 . . . . 0.0 109.445 -178.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 27.7 mt -87.88 70.86 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 -179.154 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -54.29 -50.65 55.35 Favored Glycine 0 CA--C 1.527 0.785 0 N-CA-C 109.631 -1.387 . . . . 0.0 109.631 175.022 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 7.1 m -71.24 72.21 0.63 Allowed 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.738 0.815 . . . . 0.0 109.299 169.469 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 25.9 mmtp -48.2 93.74 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.993 1.717 . . . . 0.0 111.011 -177.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 97.5 mt -44.99 -52.82 8.42 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 125.479 1.512 . . . . 0.0 113.167 -169.749 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -161.9 161.86 28.98 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 106.288 -1.745 . . . . 0.0 106.288 -174.589 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -35.67 -42.08 0.23 Allowed 'General case' 0 C--O 1.225 -0.222 0 C-N-CA 128.008 2.523 . . . . 0.0 114.364 -172.032 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.64 -56.25 0.16 Allowed 'General case' 0 CA--C 1.527 0.092 0 C-N-CA 126.118 1.767 . . . . 0.0 114.455 -177.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -67.45 -39.54 85.37 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 120.912 0.387 . . . . 0.0 111.148 -174.436 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.5 mp -61.68 -51.4 73.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 176.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 76.9 t -57.34 -42.4 80.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 C-N-CA 123.938 0.895 . . . . 0.0 110.475 -179.417 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.76 -55.21 37.79 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 119.433 1.015 . . . . 0.0 110.443 173.089 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 49.0 mt -53.35 -37.96 62.84 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 122.489 0.316 . . . . 0.0 111.544 -179.55 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.72 -65.56 0.81 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.236 0.471 . . . . 0.0 109.961 175.721 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -40.32 -39.88 1.05 Allowed 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 127.489 2.316 . . . . 0.0 111.991 -177.95 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -37.04 -51.34 0.94 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.172 1.389 . . . . 0.0 111.816 172.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -58.75 -35.64 73.05 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 121.43 -0.794 . . . . 0.0 112.232 -176.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -80.75 -49.57 10.98 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 123.141 0.577 . . . . 0.0 109.629 179.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 14.8 ttm180 -50.89 -46.72 60.64 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.617 0.767 . . . . 0.0 110.164 178.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -83.29 20.51 1.29 Allowed 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 123.257 0.623 . . . . 0.0 112.37 -179.104 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -57.86 -41.06 81.64 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 108.004 -1.109 . . . . 0.0 108.004 167.406 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -82.07 14.6 2.74 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.263 1.025 . . . . 0.0 111.81 173.774 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 41.1 mm-40 56.33 -95.04 0.05 OUTLIER 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.874 1.67 . . . . 0.0 112.427 -178.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 50.0 mm-40 -75.25 108.85 8.29 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 124.355 1.062 . . . . 0.0 112.469 -168.215 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 32.7 m -87.13 148.52 4.56 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 N-CA-C 107.483 -1.302 . . . . 0.0 107.483 167.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 15.5 p-10 -91.18 -176.68 4.66 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 123.94 0.896 . . . . 0.0 111.403 177.341 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -49.84 -62.09 1.76 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.853 0.861 . . . . 0.0 112.293 177.256 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 41.1 tp60 -60.4 -37.25 80.23 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 119.299 0.954 . . . . 0.0 111.17 -174.064 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -62.66 -46.07 89.9 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.711 -0.618 . . . . 0.0 110.705 175.753 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -55.15 -49.81 70.89 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.846 -0.534 . . . . 0.0 110.148 171.59 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 26.8 mm -56.98 -28.48 28.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 O-C-N 121.799 -0.563 . . . . 0.0 110.464 175.425 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 27.8 m -80.96 -24.48 38.07 Favored 'General case' 0 CA--C 1.529 0.171 0 O-C-N 121.301 -0.874 . . . . 0.0 112.986 173.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -62.9 -52.74 61.9 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 107.117 -1.438 . . . . 0.0 107.117 167.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 48.9 mt -62.22 -40.9 97.65 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 120.888 0.375 . . . . 0.0 111.726 175.295 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -60.82 -49.53 77.58 Favored Glycine 0 CA--C 1.521 0.428 0 N-CA-C 110.53 -1.028 . . . . 0.0 110.53 -179.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.49 -47.44 85.66 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.155 0.582 . . . . 0.0 110.026 175.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 19.5 tp -49.59 -57.22 7.54 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.455 0.645 . . . . 0.0 109.853 175.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.64 -56.47 13.41 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 124.71 1.204 . . . . 0.0 110.55 178.724 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 55.5 ttm -54.56 -46.97 73.75 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.172 0.989 . . . . 0.0 111.177 -178.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.1 mt -66.52 -52.86 41.57 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.301 0 CA-C-O 117.922 -1.037 . . . . 0.0 110.399 -175.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.436 0.0 OUTLIER -80.46 -33.59 36.59 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 120.027 1.285 . . . . 0.0 114.141 -176.611 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 22.6 m-80 -81.33 70.03 8.09 Favored 'General case' 0 CA--C 1.523 -0.088 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 170.166 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -42.82 -38.25 2.08 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 126.024 1.73 . . . . 0.0 111.699 -176.134 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -34.02 -47.68 0.28 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 126.551 1.94 . . . . 0.0 113.343 170.62 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 64.5 mt -61.64 -28.4 69.35 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.126 0.571 . . . . 0.0 112.443 -177.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -85.89 -49.17 8.08 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 118.336 0.516 . . . . 0.0 109.623 171.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.12 0 CA-C-O 117.601 -1.666 . . . . 0.0 110.031 -176.887 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.1 tpt . . . . . 0 N--CA 1.473 0.693 0 N-CA-C 110.434 -0.21 . . . . 0.0 110.434 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -73.24 77.15 1.31 Allowed 'General case' 0 CA--C 1.531 0.223 0 O-C-N 122.047 -0.408 . . . . 0.0 109.916 175.593 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.1 m -51.84 158.19 1.75 Allowed Pre-proline 0 CA--C 1.54 0.558 0 C-N-CA 124.149 0.98 . . . . 0.0 110.802 171.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -48.47 -48.9 15.81 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 122.944 2.429 . . . . 0.0 112.752 -179.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.9 mt -59.95 -44.91 94.11 Favored 'General case' 0 C--O 1.224 -0.251 0 CA-C-O 119.299 -0.381 . . . . 0.0 111.328 175.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -58.89 -46.82 86.94 Favored 'General case' 0 CA--C 1.528 0.12 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 -178.143 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -57.68 -52.4 65.58 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.383 0.673 . . . . 0.0 110.743 175.76 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.95 -46.2 88.88 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.407 0.622 . . . . 0.0 111.783 -175.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 71.2 mt -54.65 -51.88 46.69 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 171.282 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.55 -48.31 17.06 Favored Glycine 0 CA--C 1.527 0.814 0 C-N-CA 124.725 1.155 . . . . 0.0 111.804 174.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 mt -55.74 -56.42 20.65 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 117.613 0.706 . . . . 0.0 111.078 174.365 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 mp -58.3 -44.15 88.43 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 118.979 0.809 . . . . 0.0 111.696 -178.362 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 83.3 mt -55.81 -55.14 19.43 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.185 0 C-N-CA 123.316 0.646 . . . . 0.0 109.975 173.283 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.06 -50.03 56.89 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 110.541 -1.024 . . . . 0.0 110.541 -177.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 11.7 mm -53.03 -49.2 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 C-N-CA 123.371 0.668 . . . . 0.0 110.271 175.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -56.4 -62.96 1.36 Allowed 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 121.293 0.568 . . . . 0.0 109.622 177.05 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -51.82 -39.68 59.19 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.8 1.24 . . . . 0.0 111.689 -174.049 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.5 tttp -48.97 -39.42 26.49 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.079 0.951 . . . . 0.0 111.441 178.01 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -100.01 -59.85 1.64 Allowed 'General case' 0 C--O 1.234 0.261 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.6 m -51.11 -45.8 61.66 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.049 0.94 . . . . 0.0 111.117 -175.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -80.3 23.41 4.0 Favored Glycine 0 C--N 1.336 0.529 0 CA-C-O 118.624 -1.098 . . . . 0.0 113.389 -175.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -148.55 -51.58 0.17 Allowed 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 118.73 1.265 . . . . 0.0 111.31 168.079 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -101.7 46.58 0.93 Allowed 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.648 0.779 . . . . 0.0 109.763 -175.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 166.13 -151.86 20.57 Favored Glycine 0 CA--C 1.523 0.556 0 N-CA-C 105.649 -2.981 . . . . 0.0 105.649 -172.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -114.1 145.74 41.21 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 107.297 -1.372 . . . . 0.0 107.297 168.499 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.59 -20.21 4.85 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 -177.781 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 1.8 m170 -92.92 -29.9 15.66 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.212 1.005 . . . . 0.0 113.256 176.358 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 60.3 p -144.73 141.39 29.22 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.712 1.205 . . . . 0.0 112.721 -167.613 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -145.64 168.84 19.69 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 123.236 0.614 . . . . 0.0 110.531 176.017 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 72.8 m -111.1 177.05 4.78 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.187 1.395 . . . . 0.0 113.73 -174.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.5 ptpt -41.92 -53.7 3.72 Favored 'General case' 0 C--N 1.339 0.146 0 C-N-CA 126.602 1.961 . . . . 0.0 114.594 -176.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 23.5 ttmm -54.75 -50.09 69.26 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 -177.629 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -58.56 -44.14 89.61 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-O 118.693 -0.67 . . . . 0.0 111.098 177.515 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 90.0 mt -59.02 -51.2 71.09 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 119.17 0.896 . . . . 0.0 111.52 176.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 54.5 mtmt -59.01 -47.66 84.39 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 -179.022 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.3 -54.15 48.84 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-O 119.28 -0.39 . . . . 0.0 110.836 174.105 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.6 mt -44.77 -64.4 0.71 Allowed 'General case' 0 CA--C 1.522 -0.109 0 C-N-CA 124.25 1.02 . . . . 0.0 110.425 177.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 18.3 tt -60.24 -49.62 83.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 120.174 -0.61 . . . . 0.0 109.989 -175.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -55.93 -49.2 74.16 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.579 0.752 . . . . 0.0 112.332 -176.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.46 -54.4 7.09 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 -176.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -73.8 -29.98 62.47 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 118.302 -0.856 . . . . 0.0 112.72 -168.322 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 59.7 mt -94.4 95.71 9.04 Favored 'General case' 0 C--N 1.339 0.126 0 N-CA-C 107.221 -1.399 . . . . 0.0 107.221 167.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 71.0 p -75.87 60.16 1.32 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.467 1.107 . . . . 0.0 109.251 178.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 28.6 mt -86.91 -58.36 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 C-N-CA 124.501 1.12 . . . . 0.0 109.13 -173.094 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.54 -67.69 0.75 Allowed Glycine 0 CA--C 1.531 1.093 0 N-CA-C 110.326 -1.109 . . . . 0.0 110.326 -171.45 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 14.1 m -69.29 73.51 0.33 Allowed 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.483 1.513 . . . . 0.0 110.977 175.371 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 50.2 mmtm -28.72 88.89 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 128.668 2.787 . . . . 0.0 113.31 178.44 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.9 mt -60.32 118.93 7.02 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.04 0.936 . . . . 0.0 113.273 -169.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 23.9 tt0 65.41 -71.46 0.08 Allowed 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 127.125 2.17 . . . . 0.0 114.098 168.047 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -179.9 -42.94 0.01 OUTLIER 'General case' 0 C--O 1.227 -0.128 0 C-N-CA 125.145 1.378 . . . . 0.0 109.339 -168.174 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -38.54 -61.47 0.7 Allowed 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 125.035 1.334 . . . . 0.0 112.938 -176.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 58.6 tt0 -61.22 -37.82 84.39 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.047 0.539 . . . . 0.0 110.89 -175.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -62.55 -54.18 37.33 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 N-CA-C 105.974 -1.862 . . . . 0.0 105.974 -178.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 59.9 t -54.94 -39.76 50.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 CA-C-O 118.118 -0.944 . . . . 0.0 110.702 176.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 12.6 mmmt -59.96 -51.53 69.27 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 120.226 1.376 . . . . 0.0 110.414 176.292 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 85.1 mt -57.34 -37.6 72.8 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 119.322 -0.371 . . . . 0.0 110.828 -179.474 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 24.0 mmt -70.34 -62.85 1.23 Allowed 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 118.59 0.632 . . . . 0.0 109.992 175.503 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -44.29 -42.47 6.71 Favored 'General case' 0 CA--C 1.52 -0.19 0 C-N-CA 127.472 2.309 . . . . 0.0 111.425 -176.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -38.0 -50.87 1.36 Allowed 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.087 1.355 . . . . 0.0 111.391 174.178 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 71.1 mt -60.54 -35.78 76.85 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 121.924 -0.485 . . . . 0.0 111.667 -175.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -80.81 -54.76 5.32 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.437 0.695 . . . . 0.0 109.824 179.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 14.7 ttm180 -45.45 -49.8 13.13 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 124.473 1.109 . . . . 0.0 110.044 177.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -87.26 26.84 1.14 Allowed 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -174.058 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 28.5 mtmm -57.19 -36.54 70.95 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 120.016 1.28 . . . . 0.0 109.101 167.351 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -73.29 6.87 2.56 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.129 0.972 . . . . 0.0 112.652 173.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 66.14 -74.97 0.06 Allowed 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 126.378 1.871 . . . . 0.0 110.408 -174.2 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -82.05 150.5 27.53 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.766 1.226 . . . . 0.0 111.587 -173.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 23.4 m -130.86 147.2 33.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 N-CA-C 105.65 -1.981 . . . . 0.0 105.65 166.641 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -88.53 168.29 12.71 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 122.719 0.408 . . . . 0.0 111.194 175.832 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -33.45 -61.55 0.31 Allowed 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.722 1.209 . . . . 0.0 112.854 171.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 38.6 tp60 -61.92 -33.27 73.94 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 119.794 1.179 . . . . 0.0 112.042 -174.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -70.18 -40.01 74.92 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.249 -0.907 . . . . 0.0 110.095 177.076 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -56.92 -48.5 78.11 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 169.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . 0.403 ' CG2' ' CG2' ' B' ' 74' ' ' ILE . 27.3 mm -58.23 -36.64 58.62 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.255 0 O-C-N 121.535 -0.728 . . . . 0.0 110.006 175.701 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 42.5 m -64.35 -38.54 91.4 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.931 0.787 . . . . 0.0 110.489 174.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -55.88 -55.41 32.89 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 172.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 36.3 mt -59.37 -41.98 90.58 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.987 -0.445 . . . . 0.0 112.133 178.262 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.38 -39.96 87.21 Favored Glycine 0 CA--C 1.523 0.593 0 N-CA-C 110.638 -0.985 . . . . 0.0 110.638 -175.583 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.01 -50.03 67.87 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 117.597 0.699 . . . . 0.0 109.938 173.758 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -47.92 -56.84 6.64 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 123.988 0.915 . . . . 0.0 110.05 175.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.86 -62.5 1.57 Allowed 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 124.677 1.191 . . . . 0.0 110.327 175.081 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 6.5 ttp -54.92 -37.94 67.02 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.121 0.569 . . . . 0.0 112.039 -173.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 73.6 mt -69.82 -57.84 7.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 CA-C-O 117.975 -1.012 . . . . 0.0 110.877 178.083 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.438 0.2 OUTLIER -77.76 -35.14 52.05 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 120.313 1.415 . . . . 0.0 113.814 -174.208 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.3 m120 -80.55 58.79 3.32 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 106.425 -1.694 . . . . 0.0 106.425 168.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -47.09 -35.22 6.74 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 126.769 2.028 . . . . 0.0 113.505 -167.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -43.12 -36.95 1.85 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.706 1.203 . . . . 0.0 112.953 175.043 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 34.0 mt -55.02 -34.83 63.8 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 178.011 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -78.34 56.51 1.74 Allowed 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 119.185 0.902 . . . . 0.0 111.042 -178.172 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.338 0 CA-C-O 117.423 -1.765 . . . . 0.0 111.109 174.572 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 21.7 ptm . . . . . 0 N--CA 1.479 0.993 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -73.3 75.36 1.34 Allowed 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.111 0.564 . . . . 0.0 110.189 179.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.09 165.55 1.39 Allowed Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 125.53 1.532 . . . . 0.0 111.756 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo -46.14 -50.77 9.5 Favored 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 123.528 2.819 . . . . 0.0 113.052 177.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 6.0 mt -55.9 -52.51 63.85 Favored 'General case' 0 C--N 1.34 0.175 0 O-C-N 122.328 -0.233 . . . . 0.0 111.115 175.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -58.78 -43.59 90.49 Favored 'General case' 0 C--O 1.225 -0.201 0 N-CA-C 110.118 -0.326 . . . . 0.0 110.118 -175.217 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 tp-100 -61.94 -49.72 75.0 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.147 0.979 . . . . 0.0 110.441 177.534 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.87 -44.2 96.74 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.039 0.536 . . . . 0.0 111.222 -178.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 71.3 mt -54.4 -53.31 31.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 169.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -44.97 -48.25 9.45 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 124.947 1.261 . . . . 0.0 111.923 174.436 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 mt -56.61 -57.93 10.24 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 117.679 0.739 . . . . 0.0 110.895 174.199 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.0 mp -56.41 -42.77 78.54 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 119.483 1.038 . . . . 0.0 111.75 -178.35 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 71.6 mt -59.3 -55.25 24.87 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 C-N-CA 123.508 0.723 . . . . 0.0 110.779 174.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.91 -48.99 69.12 Favored Glycine 0 CA--C 1.523 0.549 0 N-CA-C 110.198 -1.161 . . . . 0.0 110.198 -177.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 9.5 mm -51.25 -49.81 28.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 C-N-CA 124.34 1.056 . . . . 0.0 110.103 173.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -56.18 -61.64 2.26 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.082 0.468 . . . . 0.0 109.772 177.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 13.5 m-70 -53.0 -37.09 61.16 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.936 0.894 . . . . 0.0 112.812 -176.679 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 62.3 tttm -47.12 -35.67 7.45 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.904 0.881 . . . . 0.0 111.368 175.862 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -102.95 -66.99 0.9 Allowed 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 173.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -52.99 -41.08 64.27 Favored 'General case' 0 C--O 1.227 -0.111 0 C-N-CA 123.899 0.88 . . . . 0.0 112.152 -170.726 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -54.7 -15.09 5.8 Favored Glycine 0 CA--C 1.527 0.793 0 CA-C-O 118.486 -1.175 . . . . 0.0 113.949 -179.009 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.61 -50.36 0.61 Allowed 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 118.978 1.389 . . . . 0.0 111.779 170.631 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -77.66 70.31 4.02 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.282 -0.886 . . . . 0.0 109.6 177.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 134.68 -121.77 2.73 Favored Glycine 0 CA--C 1.521 0.411 0 N-CA-C 107.358 -2.297 . . . . 0.0 107.358 -179.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -140.3 153.87 46.61 Favored 'General case' 0 N--CA 1.452 -0.325 0 N-CA-C 106.331 -1.729 . . . . 0.0 106.331 168.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -50.17 -21.29 1.26 Allowed 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 113.812 1.041 . . . . 0.0 113.812 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 13.9 t-160 -91.17 -28.79 17.63 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 126.045 1.738 . . . . 0.0 114.308 176.421 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 45.4 p -140.07 148.75 42.22 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.329 1.052 . . . . 0.0 113.804 -168.1 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -151.61 173.44 14.65 Favored 'General case' 0 CA--C 1.527 0.067 0 C-N-CA 123.263 0.625 . . . . 0.0 110.03 171.471 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 22.2 p -117.67 174.24 6.28 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 124.495 1.118 . . . . 0.0 113.318 -169.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 6.6 pttp -34.79 -59.77 0.47 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 126.867 2.067 . . . . 0.0 112.986 175.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 35.3 tptt -44.87 -49.51 10.87 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 124.558 1.143 . . . . 0.0 111.797 176.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -70.34 -36.0 73.94 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 122.902 0.481 . . . . 0.0 110.632 -176.329 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 34.6 mt -64.33 -46.66 82.54 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.647 0.658 . . . . 0.0 110.789 174.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -55.6 -51.87 65.7 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 174.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 68.3 mt-10 -56.51 -47.43 79.36 Favored 'General case' 0 C--O 1.218 -0.56 0 CA-C-O 118.969 -0.539 . . . . 0.0 110.856 176.073 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 8.5 mt -51.0 -53.22 35.23 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 119.574 1.079 . . . . 0.0 110.464 179.339 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 1.4 mp -56.09 -58.61 4.51 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 174.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -55.23 -43.93 75.01 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -172.254 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 6.9 mmpt? -83.11 -54.59 4.93 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 125.667 1.587 . . . . 0.0 109.916 -172.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 44.7 mm-40 -94.42 -17.26 22.68 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 -167.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 67.4 mt -118.54 69.82 0.8 Allowed 'General case' 0 N--CA 1.457 -0.082 0 C-N-CA 123.907 0.883 . . . . 0.0 108.997 170.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 14.3 p -57.6 -38.18 74.49 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 168.272 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . 0.289 4.4 tt 60.03 -50.72 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 130.182 3.393 . . . . 0.0 116.874 167.55 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 134.19 -152.15 20.5 Favored Glycine 0 CA--C 1.523 0.552 0 N-CA-C 106.142 -2.783 . . . . 0.0 106.142 -169.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 3.9 m -75.04 58.56 0.88 Allowed 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 117.806 0.803 . . . . 0.0 112.521 -177.117 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 22.3 mmtm 43.53 70.26 0.33 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.66 1.584 . . . . 0.0 110.581 178.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 16.7 mt -58.33 83.16 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.258 1.423 . . . . 0.0 113.352 -169.246 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 82.37 153.93 0.11 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 127.137 2.175 . . . . 0.0 111.225 173.44 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -42.24 -38.34 1.74 Allowed 'General case' 0 C--O 1.226 -0.142 0 C-N-CA 127.236 2.214 . . . . 0.0 113.523 -170.307 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.49 -60.31 0.15 Allowed 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 126.076 1.75 . . . . 0.0 113.344 -179.195 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -69.75 -36.84 76.15 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 122.248 0.219 . . . . 0.0 111.194 -172.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.3 mp -62.86 -55.3 24.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 178.455 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 78.3 t -55.84 -46.01 79.9 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 C-N-CA 124.709 1.204 . . . . 0.0 110.015 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -53.6 -53.47 51.28 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 118.216 0.462 . . . . 0.0 110.791 173.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 68.7 mt -56.53 -43.86 80.26 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 119.116 -0.468 . . . . 0.0 111.452 178.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 25.7 mmt -62.42 -59.27 5.22 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 118.816 0.734 . . . . 0.0 109.393 178.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -54.22 -40.76 67.97 Favored 'General case' 0 N--CA 1.457 -0.112 0 C-N-CA 125.303 1.441 . . . . 0.0 111.007 -175.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -38.93 -50.97 1.78 Allowed 'General case' 0 C--O 1.232 0.158 0 C-N-CA 125.747 1.619 . . . . 0.0 112.555 -173.794 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 3.0 pp -58.86 -39.26 80.81 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 -176.127 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -77.0 -45.7 26.42 Favored 'General case' 0 N--CA 1.456 -0.157 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 177.51 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 23.4 ttm-85 -48.93 -44.53 40.55 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.532 0.733 . . . . 0.0 109.979 179.086 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 -86.31 34.89 0.64 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.1 0.56 . . . . 0.0 111.86 179.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -55.2 -32.57 62.33 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 121.11 -0.994 . . . . 0.0 110.416 168.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -79.72 13.08 2.25 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.371 1.068 . . . . 0.0 112.566 174.409 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 68.75 -61.61 0.41 Allowed 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 127.348 2.259 . . . . 0.0 112.386 -177.187 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -110.99 158.34 18.89 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.326 1.051 . . . . 0.0 111.818 -177.468 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 36.0 m -124.9 152.39 31.19 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 C-N-CA 126.607 1.963 . . . . 0.0 106.081 167.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 10.6 p30 -91.5 169.23 10.94 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 123.156 0.582 . . . . 0.0 110.54 175.389 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -35.58 -60.67 0.5 Allowed 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 125.125 1.37 . . . . 0.0 113.243 177.019 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 37.9 tp60 -63.88 -31.46 72.65 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 119.752 1.16 . . . . 0.0 111.294 -173.012 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.67 -36.39 62.8 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 121.56 -0.712 . . . . 0.0 110.186 177.848 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -56.86 -49.59 75.04 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 168.363 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . 0.403 ' CG2' ' CG2' ' A' ' 74' ' ' ILE . 24.2 mm -57.38 -39.1 66.24 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 O-C-N 121.963 -0.461 . . . . 0.0 110.012 175.821 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 55.3 m -62.45 -40.82 97.85 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 118.946 0.793 . . . . 0.0 110.608 175.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -53.37 -55.98 20.53 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 173.492 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 51.0 mt -61.16 -40.86 95.45 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 179.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -70.26 -43.87 61.7 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 110.788 -0.925 . . . . 0.0 110.788 -174.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.5 -46.89 81.01 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 117.705 0.752 . . . . 0.0 109.894 174.466 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 12.2 tp -49.7 -56.05 11.58 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.419 0.628 . . . . 0.0 109.559 174.274 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.08 -53.63 40.01 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.882 1.273 . . . . 0.0 110.802 177.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 52.9 ttm -54.11 -49.58 68.8 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 124.31 1.044 . . . . 0.0 110.552 -179.65 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 76.4 mt -62.54 -59.19 4.75 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.33 0 CA-C-O 118.701 -0.666 . . . . 0.0 109.586 -176.475 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.388 0.1 OUTLIER -71.25 -35.11 71.3 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 118.467 -1.293 . . . . 0.0 112.938 -174.365 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 37.3 m-80 -81.07 72.08 8.08 Favored 'General case' 0 N--CA 1.462 0.16 0 O-C-N 120.793 -1.192 . . . . 0.0 108.157 170.507 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -43.81 -34.45 1.58 Allowed 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 124.918 1.287 . . . . 0.0 112.725 -179.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -41.1 -42.82 2.08 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.876 1.27 . . . . 0.0 113.189 173.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 96.1 mt -72.37 -18.06 61.77 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.409 0.684 . . . . 0.0 112.718 -177.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -92.36 -43.76 9.07 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.714 0.806 . . . . 0.0 109.933 173.036 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.177 0 CA-C-O 116.583 -2.232 . . . . 0.0 110.093 -179.145 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.474 0.736 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -78.63 73.79 5.18 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 121.192 0.52 . . . . 0.0 111.085 -174.586 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.34 167.79 3.7 Favored Pre-proline 0 CA--C 1.534 0.347 0 C-N-CA 124.795 1.238 . . . . 0.0 111.339 172.878 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_endo -49.63 -45.05 33.08 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 122.926 2.417 . . . . 0.0 111.428 171.28 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.1 mt -53.74 -57.35 11.15 Favored 'General case' 0 C--O 1.224 -0.283 0 CA-C-N 118.02 0.373 . . . . 0.0 111.317 171.606 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -56.84 -42.23 79.29 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.176 0.444 . . . . 0.0 110.831 -174.999 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 -59.74 -50.71 72.76 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.54 0.736 . . . . 0.0 110.842 175.509 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.01 -45.96 83.37 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.577 0.751 . . . . 0.0 111.632 -176.462 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 87.1 mt -53.48 -51.02 45.67 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 169.887 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.04 -49.03 18.91 Favored Glycine 0 CA--C 1.528 0.88 0 C-N-CA 124.923 1.249 . . . . 0.0 112.005 173.55 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 mt -56.82 -55.16 37.89 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 117.947 0.873 . . . . 0.0 110.864 174.893 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.0 mp -57.49 -43.6 84.27 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 119.136 0.88 . . . . 0.0 111.38 -179.024 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 95.4 mt -58.32 -53.11 50.65 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.193 0 C-N-CA 123.497 0.719 . . . . 0.0 110.362 174.207 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.42 -49.66 67.53 Favored Glycine 0 CA--C 1.524 0.596 0 N-CA-C 110.322 -1.111 . . . . 0.0 110.322 -177.953 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 9.6 mm -53.32 -48.52 55.91 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 C-N-CA 123.572 0.749 . . . . 0.0 109.885 174.91 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 53.1 t80 -56.09 -61.13 2.59 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.258 0.481 . . . . 0.0 110.056 176.921 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -51.06 -39.69 56.56 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 125.74 1.616 . . . . 0.0 111.503 -176.27 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -50.93 -36.17 37.18 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.715 0.806 . . . . 0.0 111.506 178.913 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -107.05 -38.21 6.09 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.078 0.551 . . . . 0.0 111.654 -177.929 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 59.6 p -73.88 -37.38 64.74 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 118.801 0.728 . . . . 0.0 111.772 -178.749 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -72.35 64.63 1.35 Allowed Glycine 0 C--N 1.34 0.753 0 C-N-CA 125.326 1.441 . . . . 0.0 111.788 -171.078 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.1 ptpp? 178.39 -33.37 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 127.51 2.324 . . . . 0.0 110.241 -174.739 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -77.04 47.16 0.52 Allowed 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 119.002 0.819 . . . . 0.0 112.041 -177.867 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 61.64 -81.12 0.02 OUTLIER Glycine 0 CA--C 1.528 0.888 0 C-N-CA 124.688 1.137 . . . . 0.0 111.753 -179.118 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 48.6 t0 -80.03 95.08 6.06 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 176.493 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 51.0 mttp -67.65 -10.1 49.19 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.159 0.984 . . . . 0.0 112.818 -172.217 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 20.6 t-160 -77.87 -11.16 59.87 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.262 1.425 . . . . 0.0 111.066 172.077 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.3 p -123.13 156.57 34.75 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 124.116 0.966 . . . . 0.0 111.841 179.605 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -150.21 161.58 42.14 Favored 'General case' 0 CA--C 1.528 0.109 0 C-N-CA 123.034 0.534 . . . . 0.0 111.177 168.649 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 83.7 p -87.07 164.74 16.27 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 115.638 1.718 . . . . 0.0 115.638 -168.063 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 20.7 ttmm -42.6 -54.17 4.09 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 126.878 2.071 . . . . 0.0 109.442 166.685 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -58.01 -54.27 48.79 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.075 0.95 . . . . 0.0 109.782 179.247 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.12 -34.19 73.17 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 118.91 -0.567 . . . . 0.0 111.746 -177.49 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 44.0 mt -65.61 -52.71 49.95 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 119.276 0.943 . . . . 0.0 111.345 173.999 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -60.45 -35.96 77.08 Favored 'General case' 0 CA--C 1.532 0.261 0 O-C-N 122.3 -0.25 . . . . 0.0 110.439 -179.43 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 88.4 mt-10 -60.13 -68.71 0.27 Allowed 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 168.383 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.5 mt -32.57 -61.65 0.26 Allowed 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 125.94 1.696 . . . . 0.0 112.388 -177.965 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.3 tt -57.14 -52.19 59.41 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 110.337 -0.246 . . . . 0.0 110.337 -174.844 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.0 tt0 -64.33 -44.99 89.81 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 121.905 -0.497 . . . . 0.0 111.643 -177.874 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.0 mmpt? -64.6 -51.35 63.16 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 124.894 1.278 . . . . 0.0 110.219 -175.619 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 65.1 mm-40 -90.24 -47.52 7.73 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 123.483 0.713 . . . . 0.0 111.582 -168.911 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 18.1 mt -83.17 63.41 7.16 Favored 'General case' 0 C--N 1.339 0.122 0 CA-C-N 118.976 0.807 . . . . 0.0 110.386 -177.828 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 53.2 p -74.83 69.06 1.81 Allowed 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 105.163 -2.162 . . . . 0.0 105.163 167.412 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 10.5 tt -81.81 49.44 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 124.21 1.004 . . . . 0.0 111.43 -166.982 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.65 -64.0 1.48 Allowed Glycine 0 CA--C 1.53 1.019 0 N-CA-C 110.134 -1.186 . . . . 0.0 110.134 -170.858 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 36.4 t -158.9 -172.35 3.77 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 106.394 -1.706 . . . . 0.0 106.394 169.736 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 39.1 mmtm -72.31 74.57 1.0 Allowed 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.291 0.636 . . . . 0.0 109.718 179.276 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 36.0 mt -52.28 -46.85 66.04 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.697 0.799 . . . . 0.0 112.962 -170.372 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 tm0? -156.26 149.93 24.86 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 -172.2 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -20.74 -48.42 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 130.723 3.609 . . . . 0.0 116.066 179.108 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -33.03 -59.06 0.36 Allowed 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.591 1.556 . . . . 0.0 113.396 -179.454 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -64.94 -36.88 85.8 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 121.255 0.55 . . . . 0.0 110.775 -173.815 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -65.56 -53.94 33.67 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.572 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 -178.068 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 75.4 t -57.91 -43.82 85.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 CA-C-O 118.633 -0.698 . . . . 0.0 110.451 178.86 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.72 -53.7 51.54 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 119.385 0.993 . . . . 0.0 110.459 174.301 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.6 mt -52.83 -44.26 66.58 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 119.104 -0.474 . . . . 0.0 111.404 178.651 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 25.9 mmt -66.84 -66.15 0.59 Allowed 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.529 0.604 . . . . 0.0 109.456 177.632 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -40.46 -42.68 1.67 Allowed 'General case' 0 CA--C 1.519 -0.243 0 C-N-CA 127.803 2.441 . . . . 0.0 111.648 -176.738 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -39.22 -47.7 1.68 Allowed 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 123.862 0.865 . . . . 0.0 112.72 178.042 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -64.35 -37.22 86.75 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.044 0.384 . . . . 0.0 111.385 -176.162 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -78.87 -36.88 41.52 Favored 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 123.841 0.856 . . . . 0.0 110.104 -178.284 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.2 ttm180 -60.8 -52.33 65.52 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 174.448 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 9.3 m-80 -81.44 47.23 1.02 Allowed 'General case' 0 CA--C 1.531 0.215 0 O-C-N 121.876 -0.515 . . . . 0.0 111.564 -174.346 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 36.4 mttp -59.23 -42.52 91.23 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 167.832 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -76.08 12.07 1.27 Allowed 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.227 1.011 . . . . 0.0 112.534 173.727 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 78.1 mm-40 70.62 -35.58 0.33 Allowed 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.183 1.793 . . . . 0.0 114.781 175.292 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -124.43 165.43 17.76 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 124.761 1.225 . . . . 0.0 111.803 176.483 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 16.3 m -128.04 157.17 40.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.279 0 C-N-CA 125.325 1.45 . . . . 0.0 107.787 168.62 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -87.18 171.28 10.79 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.048 0.939 . . . . 0.0 111.495 173.522 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 68.8 t80 -44.45 -62.43 1.18 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.945 0.898 . . . . 0.0 113.141 176.172 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 37.0 tp60 -61.61 -34.48 75.73 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 119.722 1.146 . . . . 0.0 110.89 -174.795 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 83.5 mt-10 -64.45 -41.06 96.76 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.445 -0.784 . . . . 0.0 110.925 175.029 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -57.47 -47.97 80.44 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 121.606 -0.684 . . . . 0.0 109.899 169.824 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 31.0 mm -60.35 -29.56 44.48 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 O-C-N 121.503 -0.748 . . . . 0.0 110.767 175.281 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 29.2 m -69.93 -40.74 75.34 Favored 'General case' 0 C--O 1.225 -0.196 0 O-C-N 121.215 -0.928 . . . . 0.0 110.197 173.413 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -56.67 -53.67 54.95 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.571 -0.706 . . . . 0.0 109.576 173.413 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 61.2 mt -63.24 -41.12 99.04 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 121.947 -0.471 . . . . 0.0 111.988 178.437 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.79 -41.26 95.77 Favored Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.737 -0.945 . . . . 0.0 110.737 -179.076 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.34 -46.99 87.93 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.269 0.627 . . . . 0.0 110.127 173.453 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 9.8 tp -51.96 -58.3 6.92 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.714 0.768 . . . . 0.0 109.774 175.402 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -47.83 -53.39 15.72 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 114.486 -1.234 . . . . 0.0 110.089 178.077 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 46.0 ttm -57.59 -51.92 67.51 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 123.684 0.794 . . . . 0.0 111.343 -179.437 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 85.6 mt -61.7 -45.13 99.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.613 -173.712 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.457 0.1 OUTLIER -83.08 -33.99 26.27 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 179.982 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 -84.66 85.57 7.42 Favored 'General case' 0 N--CA 1.463 0.222 0 O-C-N 120.845 -1.159 . . . . 0.0 108.93 173.958 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -36.89 -42.06 0.37 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.654 1.181 . . . . 0.0 113.356 171.741 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -55.33 -17.07 4.12 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 125.298 1.439 . . . . 0.0 114.304 -179.516 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 69.8 mt -108.9 10.14 26.5 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.608 1.163 . . . . 0.0 112.616 -179.114 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 25.9 mmtp -66.72 78.22 0.11 Allowed 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 119.702 1.137 . . . . 0.0 111.77 -179.791 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.239 0 CA-C-O 117.452 -1.749 . . . . 0.0 110.105 177.241 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 57.7 ttp . . . . . 0 N--CA 1.474 0.749 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -74.24 77.87 1.81 Allowed 'General case' 0 C--O 1.235 0.299 0 N-CA-C 110.135 -0.32 . . . . 0.0 110.135 177.958 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -49.54 155.32 1.38 Allowed Pre-proline 0 CA--C 1.535 0.386 0 C-N-CA 125.354 1.462 . . . . 0.0 109.959 172.189 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_exo -43.76 -52.72 5.09 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 123.38 2.72 . . . . 0.0 113.165 -177.141 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.2 mt -55.44 -55.62 29.57 Favored 'General case' 0 C--O 1.226 -0.153 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 173.514 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -58.18 -38.17 76.15 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-N 118.301 0.5 . . . . 0.0 110.332 -175.048 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -68.55 -49.19 61.39 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 125.088 1.355 . . . . 0.0 110.155 -179.313 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.35 -47.39 86.25 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.553 0.741 . . . . 0.0 110.648 177.991 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 70.0 mt -52.48 -53.86 17.9 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 169.956 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.84 -44.24 17.63 Favored Glycine 0 CA--C 1.526 0.736 0 C-N-CA 125.752 1.644 . . . . 0.0 112.322 175.977 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.68 -53.01 62.96 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.809 0.844 . . . . 0.0 110.686 174.683 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 11.0 mp -58.25 -41.43 84.2 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 119.01 0.823 . . . . 0.0 111.395 178.008 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 84.6 mt -60.29 -51.7 69.91 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 123.651 0.78 . . . . 0.0 110.735 174.563 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.48 -49.21 70.74 Favored Glycine 0 CA--C 1.521 0.445 0 N-CA-C 109.685 -1.366 . . . . 0.0 109.685 -179.083 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.2 mm -54.42 -46.41 70.36 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 C-N-CA 123.139 0.576 . . . . 0.0 110.409 174.594 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 58.5 t80 -55.27 -62.65 1.53 Allowed 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 118.974 0.806 . . . . 0.0 109.949 175.205 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -53.15 -38.42 62.72 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.329 1.052 . . . . 0.0 111.66 -175.092 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -47.86 -38.39 16.06 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.059 0.944 . . . . 0.0 111.391 176.986 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -99.35 -59.09 1.79 Allowed 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 177.343 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 4.7 m -51.49 -37.1 47.47 Favored 'General case' 0 C--O 1.227 -0.1 0 C-N-CA 124.215 1.006 . . . . 0.0 112.507 -175.019 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -40.95 -47.47 4.14 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 124.018 0.818 . . . . 0.0 111.728 173.856 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -66.18 -23.07 66.39 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -173.782 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -73.84 -11.56 60.41 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.098 0.559 . . . . 0.0 111.622 179.427 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 76.76 -59.59 3.41 Favored Glycine 0 CA--C 1.529 0.946 0 N-CA-C 110.182 -1.167 . . . . 0.0 110.182 -176.506 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 62.6 t0 -77.81 63.24 2.82 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 171.131 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 63.8 pttt -71.78 7.33 1.57 Allowed 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 114.797 1.406 . . . . 0.0 114.797 -168.523 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 3.8 m80 -77.62 -22.49 50.67 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 168.608 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 2.4 p -122.56 167.32 13.52 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 127.232 2.213 . . . . 0.0 110.381 -179.888 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -152.53 163.52 39.42 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.771 0.829 . . . . 0.0 109.523 167.568 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 14.5 m -84.98 147.17 26.84 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.265 1.026 . . . . 0.0 110.241 176.987 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -53.7 -31.43 47.97 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 -175.176 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.4 tmmt? -50.34 -43.52 54.1 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.884 -0.51 . . . . 0.0 110.184 172.024 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -65.89 -29.68 70.15 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-O 117.847 -1.073 . . . . 0.0 111.794 177.107 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 89.5 mt -65.5 -48.88 71.05 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 120.522 1.51 . . . . 0.0 109.299 174.409 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 59.4 mtmt -60.5 -44.78 95.62 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.228 179.789 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 72.7 mt-10 -55.07 -66.52 0.39 Allowed 'General case' 0 C--O 1.219 -0.536 0 CA-C-O 118.552 -0.737 . . . . 0.0 109.585 170.252 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 9.4 mt -35.93 -60.56 0.53 Allowed 'General case' 0 C--O 1.23 0.065 0 C-N-CA 125.294 1.437 . . . . 0.0 111.475 -179.82 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 1.5 tp -60.36 -51.68 70.16 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.103 -174.605 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -66.07 -44.75 83.6 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.728 0.694 . . . . 0.0 111.986 -175.463 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 6.9 mmpt? -61.87 -58.89 6.21 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 125.4 1.48 . . . . 0.0 109.26 -179.138 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -79.46 -54.76 5.6 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.782 -0.644 . . . . 0.0 109.3 -170.069 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 42.1 mt -83.91 63.15 7.4 Favored 'General case' 0 C--N 1.334 -0.084 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 172.291 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 3.0 t -75.17 55.89 0.77 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.997 0.919 . . . . 0.0 109.435 172.994 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 76.2 mt -74.02 84.41 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 -178.505 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.69 70.55 0.39 Allowed Glycine 0 CA--C 1.531 1.073 0 C-N-CA 124.099 0.857 . . . . 0.0 111.65 177.461 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 19.6 m 140.47 72.32 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 131.518 3.927 . . . . 0.0 106.03 -174.064 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 37.6 mttt -61.67 98.43 0.09 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.201 0.6 . . . . 0.0 111.02 -169.866 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 88.4 mt -40.39 -41.74 1.44 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 127.296 2.238 . . . . 0.0 115.437 -170.466 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -155.13 162.85 40.88 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 105.694 -1.965 . . . . 0.0 105.694 -171.515 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -49.08 -30.63 6.66 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 125.135 1.374 . . . . 0.0 113.524 -175.213 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.25 -66.65 0.09 Allowed 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 126.983 2.113 . . . . 0.0 114.221 -174.732 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -65.34 -39.16 92.03 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-O 121.051 0.453 . . . . 0.0 110.222 -171.024 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 1.6 mp -64.35 -54.23 33.42 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 -176.946 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 75.6 t -58.09 -44.05 86.55 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.459 0 CA-C-O 118.406 -0.807 . . . . 0.0 110.196 178.794 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -54.92 -52.87 61.6 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 119.528 1.058 . . . . 0.0 110.509 174.396 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 37.0 mt -54.21 -46.18 72.39 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 119.17 -0.443 . . . . 0.0 111.243 179.496 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 26.5 mmt -66.9 -59.24 3.68 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.534 0.683 . . . . 0.0 109.868 179.309 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -48.71 -39.73 25.77 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 126.58 1.952 . . . . 0.0 111.337 -177.079 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -37.6 -50.22 1.14 Allowed 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 126.024 1.73 . . . . 0.0 112.507 -174.195 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 3.1 pp -62.97 -35.57 80.61 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 -175.366 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -85.99 -33.2 21.15 Favored 'General case' 0 C--O 1.224 -0.286 0 C-N-CA 123.184 0.593 . . . . 0.0 110.457 178.512 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 6.6 ttp180 -58.86 -56.62 19.84 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 122.111 0.957 . . . . 0.0 108.603 175.186 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 -84.65 57.24 4.24 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.238 1.015 . . . . 0.0 109.74 -172.73 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 51.2 mttp -55.84 -37.1 68.28 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.274 0.559 . . . . 0.0 110.489 177.554 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -64.08 -11.03 25.95 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.758 1.223 . . . . 0.0 113.081 177.357 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 76.89 -54.72 0.57 Allowed 'General case' 0 C--O 1.233 0.196 0 C-N-CA 126.632 1.973 . . . . 0.0 110.109 -177.707 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -97.15 156.53 16.35 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.445 0.698 . . . . 0.0 110.923 170.541 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 6.0 m -136.88 160.0 36.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 C-N-CA 124.122 0.969 . . . . 0.0 109.471 169.236 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 17.4 p30 -85.94 169.2 13.48 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 125.759 1.623 . . . . 0.0 110.886 174.327 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -39.92 -58.75 1.33 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.982 1.313 . . . . 0.0 113.664 173.932 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 38.4 tp60 -61.76 -40.97 97.0 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 120.786 -1.196 . . . . 0.0 110.981 -174.239 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -68.02 -33.82 75.32 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.78 -0.575 . . . . 0.0 110.862 177.94 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -57.72 -55.09 39.33 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 168.669 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 22.1 mm -52.79 -42.62 42.89 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.212 0 C-N-CA 122.821 0.448 . . . . 0.0 109.95 179.7 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 49.5 m -55.4 -36.29 66.28 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 122.779 0.432 . . . . 0.0 111.376 178.425 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 18.3 t80 -58.46 -53.1 62.09 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 174.969 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 41.8 mt -60.51 -43.07 97.45 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.056 0.542 . . . . 0.0 111.17 178.715 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.23 -46.77 86.05 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 -176.654 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.39 -46.92 88.15 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 117.696 0.748 . . . . 0.0 110.543 175.84 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -51.83 -56.15 15.72 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.766 0.793 . . . . 0.0 109.983 174.426 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.43 -48.98 65.44 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 124.113 0.965 . . . . 0.0 110.474 178.457 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 50.3 ttm -58.3 -49.5 76.93 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.912 0.885 . . . . 0.0 110.971 179.855 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 84.1 mt -64.6 -43.39 96.72 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 CA-C-O 118.186 -0.912 . . . . 0.0 111.233 -175.596 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.445 1.3 p90 -79.43 -40.34 30.18 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.784 1.174 . . . . 0.0 113.607 178.694 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 37.4 m-80 -79.14 70.73 5.56 Favored 'General case' 0 N--CA 1.462 0.136 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 170.567 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -40.89 -41.98 1.73 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.521 1.528 . . . . 0.0 112.6 -174.841 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.29 -54.33 0.4 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.766 1.626 . . . . 0.0 113.044 169.954 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 85.4 mt -66.88 -5.19 11.49 Favored 'General case' 0 C--O 1.225 -0.235 0 C-N-CA 124.146 0.978 . . . . 0.0 113.146 -173.555 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -70.27 -31.82 69.36 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 119.982 1.265 . . . . 0.0 109.741 169.246 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.133 0 CA-C-O 116.932 -2.038 . . . . 0.0 110.912 -177.686 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 92.5 mtp . . . . . 0 N--CA 1.475 0.782 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -78.18 67.85 4.09 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-O 120.862 0.363 . . . . 0.0 110.238 178.809 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 4.2 m -53.35 160.54 1.74 Allowed Pre-proline 0 CA--C 1.536 0.442 0 C-N-CA 124.278 1.031 . . . . 0.0 111.113 175.09 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_exo -43.15 -49.5 7.13 Favored 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 123.528 2.819 . . . . 0.0 113.172 176.28 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 7.3 mt -57.25 -48.5 78.68 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 119.305 -0.379 . . . . 0.0 111.719 174.577 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -59.41 -47.18 86.46 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 118.548 0.613 . . . . 0.0 109.666 -177.081 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 16.0 tt0 -56.08 -52.69 63.38 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.355 0.662 . . . . 0.0 110.375 176.209 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.52 -45.11 84.75 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.383 0.673 . . . . 0.0 112.023 -174.606 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 76.0 mt -55.69 -50.18 69.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 171.534 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.21 -50.03 17.68 Favored Glycine 0 CA--C 1.528 0.863 0 C-N-CA 124.422 1.011 . . . . 0.0 111.488 173.609 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.1 mt -55.83 -56.76 16.77 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 117.586 0.693 . . . . 0.0 111.282 174.848 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -58.32 -44.14 88.51 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 119.257 0.935 . . . . 0.0 111.639 -177.659 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 96.3 mt -56.49 -54.91 22.77 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.2 0 C-N-CA 123.413 0.685 . . . . 0.0 110.198 173.181 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.64 -50.15 58.62 Favored Glycine 0 CA--C 1.523 0.567 0 N-CA-C 110.364 -1.094 . . . . 0.0 110.364 -177.351 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 9.5 mm -54.27 -47.62 68.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 C-N-CA 123.229 0.611 . . . . 0.0 110.107 175.915 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 50.6 t80 -56.1 -59.35 5.05 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.401 0.546 . . . . 0.0 109.998 176.506 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -56.62 -35.47 68.34 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.734 1.214 . . . . 0.0 111.514 -173.732 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -48.88 -36.33 16.81 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.943 0.897 . . . . 0.0 111.779 177.143 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 54.6 m-85 -106.81 -55.73 2.29 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.34 0.656 . . . . 0.0 109.393 178.461 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.9 -32.08 60.7 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 124.103 0.961 . . . . 0.0 111.645 -176.38 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -47.17 -34.23 8.01 Favored Glycine 0 CA--C 1.526 0.769 0 CA-C-O 118.745 -1.031 . . . . 0.0 114.192 179.803 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.93 -1.8 48.47 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 118.48 1.14 . . . . 0.0 113.691 -178.168 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -79.49 132.43 36.33 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 106.011 -1.848 . . . . 0.0 106.011 169.637 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -48.3 -58.08 7.56 Favored Glycine 0 CA--C 1.528 0.898 0 N-CA-C 111.4 -0.68 . . . . 0.0 111.4 -174.657 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -79.96 86.27 5.48 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 106.719 -1.585 . . . . 0.0 106.719 168.758 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 31.6 mtmm -58.58 -15.2 10.4 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.745 1.218 . . . . 0.0 113.501 -174.127 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 16.6 t-160 -75.64 -15.7 60.3 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.117 1.367 . . . . 0.0 110.465 176.135 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.3 p -121.27 149.56 42.7 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 125.196 1.399 . . . . 0.0 111.27 179.286 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -144.46 163.56 33.45 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.573 0.349 . . . . 0.0 111.526 169.709 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 9.7 m -89.36 159.89 17.12 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.095 0.958 . . . . 0.0 113.438 -170.667 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 51.6 pttt -45.99 -42.84 13.64 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 125.272 1.429 . . . . 0.0 112.184 171.793 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 23.2 ttmm -51.97 -50.47 61.2 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 123.483 0.713 . . . . 0.0 110.302 172.815 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 -65.83 -39.99 91.35 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 118.776 -0.631 . . . . 0.0 110.324 -176.897 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 76.0 mt -58.82 -54.97 41.13 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.77 0.713 . . . . 0.0 111.161 173.462 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 61.8 mttm -56.56 -44.27 80.8 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.236 0.614 . . . . 0.0 110.187 -178.422 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -56.81 -67.93 0.27 Allowed 'General case' 0 C--O 1.219 -0.507 0 CA-C-O 118.423 -0.799 . . . . 0.0 109.473 170.555 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.7 mt -34.07 -62.98 0.3 Allowed 'General case' 0 N--CA 1.463 0.209 0 C-N-CA 125.594 1.558 . . . . 0.0 112.132 -178.542 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 18.1 tt -61.26 -48.0 90.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 C-N-CA 120.899 -0.321 . . . . 0.0 110.265 -174.356 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -62.91 -45.55 91.98 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.783 -0.573 . . . . 0.0 111.712 -178.065 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.2 mmpt? -65.07 -58.68 5.44 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 125.397 1.479 . . . . 0.0 109.059 -176.727 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -77.78 -62.36 1.69 Allowed 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.311 -173.226 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 32.8 mt -85.2 61.99 7.22 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 121.394 0.616 . . . . 0.0 109.557 -174.956 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.4 t -75.41 60.37 1.15 Allowed 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 106.278 -1.749 . . . . 0.0 106.278 166.945 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 4.8 tt -76.52 81.95 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 C-N-CA 124.011 0.924 . . . . 0.0 110.401 -166.963 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 49.05 50.77 26.93 Favored Glycine 0 CA--C 1.524 0.636 0 C-N-CA 125.339 1.447 . . . . 0.0 112.269 169.932 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.6 m 56.72 44.73 23.11 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.595 0.758 . . . . 0.0 112.052 -176.346 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 62.5 mttm 71.9 62.81 0.14 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.451 1.5 . . . . 0.0 110.875 171.353 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 46.9 mt -35.88 -52.77 0.74 Allowed 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 114.59 1.33 . . . . 0.0 114.59 -177.358 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -150.27 146.91 27.07 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 121.009 0.433 . . . . 0.0 110.703 -170.382 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -25.8 -46.61 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 130.469 3.508 . . . . 0.0 115.207 -176.863 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -31.99 -58.15 0.3 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 125.49 1.516 . . . . 0.0 113.35 176.866 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -65.92 -38.42 88.64 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 121.268 0.556 . . . . 0.0 111.197 -175.289 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -66.06 -50.13 71.55 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 N-CA-C 106.864 -1.532 . . . . 0.0 106.864 -176.157 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 71.6 t -55.49 -54.31 26.87 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 CA-C-O 118.475 -0.774 . . . . 0.0 109.364 174.682 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -47.98 -54.45 12.82 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.629 0.65 . . . . 0.0 110.847 179.332 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 12.8 mt -51.94 -43.35 63.42 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 122.879 0.472 . . . . 0.0 112.197 -177.249 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -78.69 -59.38 2.8 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 122.926 0.49 . . . . 0.0 110.335 -179.661 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -39.71 -37.2 0.49 Allowed 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 126.785 2.034 . . . . 0.0 111.872 176.575 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -36.75 -57.3 0.8 Allowed 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 125.239 1.416 . . . . 0.0 111.408 172.871 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -65.42 -30.75 71.59 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 121.856 -0.527 . . . . 0.0 111.658 -174.346 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -82.1 -36.67 27.33 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.43 0.692 . . . . 0.0 110.523 -175.036 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 13.1 ptt180 -75.06 -44.95 44.68 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 118.813 0.733 . . . . 0.0 109.422 173.714 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -76.45 51.2 0.7 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.119 0.968 . . . . 0.0 110.535 178.679 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 53.2 mttp -58.45 -44.07 89.05 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.38 -0.825 . . . . 0.0 108.968 177.132 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -84.35 23.2 1.13 Allowed 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.158 0.983 . . . . 0.0 111.609 175.874 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 71.8 -49.7 0.69 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 126.298 1.839 . . . . 0.0 114.183 174.019 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -99.89 159.89 14.73 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 -177.182 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.7 m -134.37 159.43 42.01 Favored 'Isoleucine or valine' 0 C--O 1.232 0.159 0 C-N-CA 126.224 1.81 . . . . 0.0 107.805 169.406 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -91.44 174.26 7.47 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 123.612 0.765 . . . . 0.0 111.59 175.798 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 49.3 t80 -42.31 -63.46 0.75 Allowed 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.376 1.07 . . . . 0.0 112.84 173.839 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -61.64 -35.25 77.38 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 120.329 1.422 . . . . 0.0 111.694 -176.179 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -63.6 -41.4 98.32 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 119.836 1.198 . . . . 0.0 111.315 174.33 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -55.04 -51.63 65.69 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 121.01 -1.056 . . . . 0.0 109.608 169.853 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 23.8 mm -55.97 -36.13 43.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 C-N-CA 122.804 0.442 . . . . 0.0 110.245 176.395 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 56.8 m -67.2 -34.48 77.6 Favored 'General case' 0 C--O 1.225 -0.223 0 O-C-N 121.302 -0.874 . . . . 0.0 110.635 177.06 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -53.91 -54.48 38.2 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 169.813 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 59.6 mt -64.2 -41.36 97.11 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.306 0.642 . . . . 0.0 112.034 -178.254 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -70.16 -44.46 60.27 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.416 -1.073 . . . . 0.0 110.416 -176.689 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.08 -49.58 76.74 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 122.171 -0.605 . . . . 0.0 109.754 174.393 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 11.1 tp -48.45 -59.27 3.61 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.464 0.65 . . . . 0.0 109.988 173.922 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -49.64 -53.02 26.59 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.804 1.242 . . . . 0.0 110.581 179.773 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 14.2 ttp -67.1 -36.61 82.31 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 123.357 0.663 . . . . 0.0 111.92 -175.166 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.93 -59.39 4.35 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 CA-C-N 118.791 0.723 . . . . 0.0 109.52 175.679 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.417 0.3 OUTLIER -70.91 -38.33 72.95 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 118.512 -1.275 . . . . 0.0 112.424 -174.21 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -81.78 67.68 7.85 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 120.545 -1.347 . . . . 0.0 107.639 168.994 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -41.24 -40.13 1.53 Allowed 'General case' 0 N--CA 1.462 0.155 0 C-N-CA 125.767 1.627 . . . . 0.0 112.293 -175.242 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -34.55 -53.28 0.52 Allowed 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 125.352 1.461 . . . . 0.0 113.037 172.401 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 90.9 mt -61.0 -15.52 32.71 Favored 'General case' 0 C--O 1.225 -0.23 0 N-CA-C 113.156 0.798 . . . . 0.0 113.156 -174.226 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -66.18 -28.82 69.06 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.751 1.159 . . . . 0.0 111.404 175.079 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.345 0 CA-C-O 117.225 -1.875 . . . . 0.0 111.857 -174.234 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 3.2 mpp? . . . . . 0 N--CA 1.471 0.583 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -76.21 69.89 2.79 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 177.195 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 11.9 m -53.8 159.7 2.51 Favored Pre-proline 0 CA--C 1.537 0.479 0 C-N-CA 123.741 0.816 . . . . 0.0 111.147 176.512 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_exo -42.11 -48.83 6.19 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 123.868 3.045 . . . . 0.0 113.507 177.645 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 6.3 mt -54.25 -51.11 65.55 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 119.564 -0.255 . . . . 0.0 111.521 174.051 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -62.99 -40.46 97.8 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 118.254 0.479 . . . . 0.0 110.144 -175.674 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.7 tp60 -63.9 -46.35 85.24 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 122.512 -0.118 . . . . 0.0 110.96 176.391 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.31 -46.01 88.71 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.593 0.757 . . . . 0.0 110.819 -179.313 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 63.0 mt -52.84 -53.23 22.27 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.254 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 169.678 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.77 -46.66 18.86 Favored Glycine 0 CA--C 1.528 0.854 0 C-N-CA 125.164 1.364 . . . . 0.0 112.05 175.422 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 mt -58.09 -54.19 49.81 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 117.71 0.755 . . . . 0.0 111.166 174.534 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 9.9 mp -57.91 -42.78 85.49 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 118.791 0.723 . . . . 0.0 111.407 179.323 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 85.9 mt -56.4 -56.13 15.27 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.401 0 C-N-CA 123.629 0.772 . . . . 0.0 109.669 173.316 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.2 -48.8 62.23 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.749 -0.94 . . . . 0.0 110.749 -177.754 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 9.1 mm -56.44 -47.23 81.93 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 175.978 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -55.99 -60.81 2.94 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 118.626 0.648 . . . . 0.0 109.923 176.484 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -43.32 -50.1 6.73 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 128.168 2.587 . . . . 0.0 110.467 -177.992 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -48.38 -36.84 15.41 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.583 1.153 . . . . 0.0 112.355 178.266 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 -119.48 36.12 4.6 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.124 0.97 . . . . 0.0 111.236 179.875 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 19.9 p -159.83 -64.47 0.07 Allowed 'General case' 0 N--CA 1.466 0.372 0 O-C-N 121.309 -0.869 . . . . 0.0 109.793 172.505 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -61.24 72.02 0.01 OUTLIER Glycine 0 CA--C 1.522 0.514 0 C-N-CA 127.051 2.263 . . . . 0.0 111.87 177.248 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 11.2 ptmm? -165.83 -122.55 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 125.36 1.464 . . . . 0.0 107.332 176.13 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -76.06 62.58 1.69 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.436 1.095 . . . . 0.0 110.666 -177.075 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 177.71 -177.3 48.33 Favored Glycine 0 CA--C 1.525 0.676 0 O-C-N 121.74 -0.6 . . . . 0.0 112.151 179.679 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -77.91 79.95 4.37 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 -178.523 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 34.6 mttp -29.77 -30.55 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 130.768 3.627 . . . . 0.0 117.849 -171.67 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 20.1 t-160 -76.17 -13.35 60.19 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.546 1.138 . . . . 0.0 111.358 179.275 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 73.4 p -128.33 164.81 21.83 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 124.819 1.248 . . . . 0.0 112.393 -173.136 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 3.4 pp -156.49 178.18 10.61 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.88 1.672 . . . . 0.0 107.225 169.78 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 61.8 p -123.46 177.03 5.82 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 119.326 0.966 . . . . 0.0 112.43 -177.369 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 7.0 ptpp? -40.3 -46.88 2.4 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 125.475 1.51 . . . . 0.0 112.945 175.659 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -62.59 -42.64 99.68 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -176.3 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -67.58 -41.44 84.12 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.301 178.182 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 13.7 mt -58.98 -48.89 79.95 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 119.424 1.011 . . . . 0.0 111.107 175.23 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -57.22 -50.52 72.62 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 178.341 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 64.2 mt-10 -50.8 -62.25 1.72 Allowed 'General case' 0 C--O 1.223 -0.334 0 CA-C-O 119.432 -0.318 . . . . 0.0 110.359 173.619 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 12.3 mt -43.1 -64.86 0.56 Allowed 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.86 1.264 . . . . 0.0 110.841 179.573 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 13.8 tt -61.66 -47.73 91.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 C-N-CA 120.452 -0.499 . . . . 0.0 110.382 -171.456 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -67.37 -49.38 64.19 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 118.271 0.487 . . . . 0.0 111.819 -176.009 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.15 -55.38 16.65 Favored 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 -178.054 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -73.03 -51.21 19.05 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 122.354 -0.216 . . . . 0.0 110.43 -172.211 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 96.0 mt -102.41 63.53 0.88 Allowed 'General case' 0 C--O 1.226 -0.139 0 CA-C-O 121.205 0.526 . . . . 0.0 111.099 -174.043 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 12.0 p -60.97 -39.61 90.24 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 165.569 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . 0.26 11.0 tt 51.19 52.57 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.262 0 C-N-CA 127.593 2.357 . . . . 0.0 110.046 169.616 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.16 -74.96 0.81 Allowed Glycine 0 CA--C 1.525 0.666 0 N-CA-C 109.05 -1.62 . . . . 0.0 109.05 -172.422 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 17.7 m -166.46 74.07 0.16 Allowed 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 125.345 1.458 . . . . 0.0 109.354 176.41 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 68.8 mttm 51.68 66.4 1.21 Allowed 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 168.887 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 18.0 mt -65.6 96.56 0.27 Allowed 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.928 -0.482 . . . . 0.0 111.034 -177.338 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 tm0? 79.59 152.75 0.12 Allowed 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.921 1.688 . . . . 0.0 110.92 171.376 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -39.84 -38.36 0.66 Allowed 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 126.649 1.98 . . . . 0.0 114.66 -170.726 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.68 -60.63 0.15 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.999 1.72 . . . . 0.0 114.264 -179.198 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -65.59 -38.69 90.23 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 121.306 0.574 . . . . 0.0 111.307 -174.058 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 53' ' ' ILE . . . . . . . . . . . . . 2.4 mp -67.69 -52.97 34.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.548 0 N-CA-C 106.597 -1.631 . . . . 0.0 106.597 -176.443 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 55.4 t -49.18 -48.92 17.41 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 C-N-CA 125.003 1.321 . . . . 0.0 109.645 173.467 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -57.67 -50.02 74.56 Favored 'General case' 0 N--CA 1.457 -0.111 0 CA-C-N 118.577 0.626 . . . . 0.0 111.119 177.708 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 23.9 mt -54.74 -36.6 64.96 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 119.111 -0.471 . . . . 0.0 111.487 177.381 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 28.1 mmt -70.1 -59.52 2.85 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 118.963 0.801 . . . . 0.0 109.838 174.676 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 81.0 m-20 -45.55 -37.39 5.4 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 126.549 1.94 . . . . 0.0 111.27 -178.483 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -38.08 -51.9 1.41 Allowed 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 126.039 1.736 . . . . 0.0 111.029 176.398 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -59.77 -47.42 85.74 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 122.702 0.401 . . . . 0.0 110.35 -177.864 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -63.1 -53.96 45.41 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 122.703 0.401 . . . . 0.0 110.072 -179.418 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 61.4 mtp180 -54.98 -41.86 71.73 Favored 'General case' 0 N--CA 1.456 -0.157 0 O-C-N 121.955 -0.466 . . . . 0.0 110.301 179.897 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 15.4 m-80 -87.35 30.62 0.78 Allowed 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 179.098 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 40.5 mtpt -57.54 -39.13 75.94 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 166.278 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -73.63 6.76 2.86 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.555 1.142 . . . . 0.0 112.803 173.398 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 70.91 -55.24 0.65 Allowed 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 127.013 2.125 . . . . 0.0 113.152 179.34 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -101.65 156.29 17.58 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.534 1.134 . . . . 0.0 110.74 178.325 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 10.1 m -130.92 158.63 43.26 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 C-N-CA 126.686 1.995 . . . . 0.0 106.666 168.849 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -99.81 175.2 5.87 Favored 'General case' 0 N--CA 1.462 0.13 0 C-N-CA 124.053 0.941 . . . . 0.0 111.13 177.688 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -40.96 -63.83 0.62 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.239 1.015 . . . . 0.0 112.61 172.38 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 50.9 tp60 -61.52 -36.34 80.28 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 119.59 1.087 . . . . 0.0 111.711 -174.842 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -62.7 -43.01 99.9 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.374 -0.829 . . . . 0.0 110.775 175.62 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -56.29 -51.29 68.71 Favored 'General case' 0 CA--C 1.535 0.403 0 O-C-N 121.838 -0.539 . . . . 0.0 109.884 170.975 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 27.5 mm -55.58 -37.57 46.4 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 O-C-N 121.959 -0.463 . . . . 0.0 110.289 177.554 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 47.8 m -64.76 -37.11 86.51 Favored 'General case' 0 CA--C 1.529 0.139 0 O-C-N 121.682 -0.636 . . . . 0.0 110.603 175.95 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -55.82 -52.98 62.14 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 173.663 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 54.6 mt -62.29 -44.69 95.94 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.55 179.377 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -60.99 -47.91 88.9 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 110.681 -0.968 . . . . 0.0 110.681 -178.901 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.16 -41.22 94.9 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 122.147 -0.619 . . . . 0.0 110.407 177.433 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 23.0 tp -54.04 -56.82 14.36 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 118.636 0.653 . . . . 0.0 109.688 174.611 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -48.58 -50.92 30.36 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 124.524 1.129 . . . . 0.0 109.989 175.891 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 44.7 ttm -58.15 -49.11 78.12 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.209 0.604 . . . . 0.0 111.669 -179.078 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 81.1 mt -65.27 -51.12 68.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.67 -176.033 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.45 0.1 OUTLIER -76.34 -38.64 55.63 Favored 'General case' 0 C--N 1.345 0.392 0 CA-C-N 119.678 1.127 . . . . 0.0 112.958 -177.153 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 23.2 m-80 -82.93 68.57 9.47 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 169.33 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 87.8 mt-10 -41.56 -38.57 1.37 Allowed 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 125.749 1.619 . . . . 0.0 112.688 -173.309 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -35.44 -53.97 0.66 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.046 1.338 . . . . 0.0 112.768 171.583 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 92.3 mt -64.98 -7.1 10.27 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.037 0.935 . . . . 0.0 113.347 -174.46 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -67.29 -32.95 74.29 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 120.059 1.3 . . . . 0.0 110.484 170.45 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.083 0 CA-C-O 117.69 -1.617 . . . . 0.0 111.995 -172.838 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.262 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -56.57 165.04 1.76 Allowed Pre-proline 0 CA--C 1.538 0.499 0 C-N-CA 124.651 1.18 . . . . 0.0 111.461 -179.556 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -44.03 -48.49 9.32 Favored 'Trans proline' 0 N--CA 1.458 -0.563 0 C-N-CA 123.805 3.004 . . . . 0.0 113.535 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.1 mt -53.39 -56.7 14.59 Favored 'General case' 0 C--O 1.226 -0.173 0 CA-C-N 117.66 0.209 . . . . 0.0 111.47 173.247 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -59.82 -41.78 92.05 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -174.488 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 tp-100 -60.47 -50.13 74.81 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.619 0.767 . . . . 0.0 110.437 176.8 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.31 -44.77 94.02 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.331 0.652 . . . . 0.0 111.213 -178.28 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 74.1 mt -52.41 -53.01 21.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 169.676 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.55 -47.97 17.24 Favored Glycine 0 CA--C 1.528 0.85 0 C-N-CA 125.254 1.406 . . . . 0.0 112.029 174.762 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 mt -56.77 -55.9 28.39 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 117.904 0.852 . . . . 0.0 111.051 174.502 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -56.92 -42.61 80.3 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 119.152 0.887 . . . . 0.0 111.318 -179.127 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 87.3 mt -57.11 -54.42 30.46 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 C-N-CA 123.305 0.642 . . . . 0.0 110.843 172.774 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.91 -49.87 64.32 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.211 -1.155 . . . . 0.0 110.211 -177.387 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 12.5 mm -52.48 -50.14 40.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 C-N-CA 124.027 0.931 . . . . 0.0 110.067 175.339 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -53.79 -62.29 1.75 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 121.346 0.593 . . . . 0.0 109.822 176.088 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -55.39 -35.12 64.98 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.001 0.92 . . . . 0.0 111.873 -173.67 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -48.7 -36.3 15.87 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.886 0.874 . . . . 0.0 111.659 176.416 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 56.3 m-85 -103.61 -56.43 2.21 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 123.125 0.57 . . . . 0.0 109.756 176.896 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.0 m . . . . . 0 C--O 1.227 -0.08 0 C-N-CA 123.533 0.733 . . . . 0.0 111.93 -176.792 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 69.5 p . . . . . 0 N--CA 1.452 -0.374 0 CA-C-O 120.884 0.373 . . . . 0.0 110.815 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.83 -171.73 3.21 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 125.952 1.701 . . . . 0.0 107.556 168.26 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 92.2 p -145.49 177.0 9.17 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 119.589 1.086 . . . . 0.0 112.672 -176.156 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -18.61 -64.64 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 130.919 3.687 . . . . 0.0 113.257 172.402 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.09 -53.23 59.57 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 123.918 0.887 . . . . 0.0 111.201 -178.016 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -61.87 -38.08 86.95 Favored 'General case' 0 C--O 1.222 -0.357 0 C-N-CA 123.077 0.551 . . . . 0.0 110.424 179.481 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 43.7 mt -64.81 -48.78 73.17 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 118.676 0.671 . . . . 0.0 110.979 178.658 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -57.69 -47.9 81.04 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 110.218 -0.29 . . . . 0.0 110.218 175.768 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -52.14 -59.14 4.72 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-O 119.396 -0.335 . . . . 0.0 110.695 172.732 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.3 mt -45.01 -61.53 1.59 Allowed 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 124.771 1.228 . . . . 0.0 110.551 -178.164 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 12.5 tt -62.08 -51.55 71.07 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 119.983 -0.687 . . . . 0.0 109.717 -174.406 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -61.88 -44.8 96.07 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.8 -0.562 . . . . 0.0 112.263 -174.493 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -75.12 -58.28 3.38 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 -177.545 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 18.0 mp0 -77.66 -18.82 56.32 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 117.634 -1.174 . . . . 0.0 113.305 -168.829 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 67.0 mt . . . . . 0 C--N 1.34 0.177 0 CA-C-N 120.133 1.333 . . . . 0.0 107.639 167.259 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 23.0 t70 . . . . . 0 CA--C 1.521 -0.15 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -34.89 -63.21 0.33 Allowed 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 125.144 1.378 . . . . 0.0 112.796 -178.074 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 67.4 tt0 -62.9 -37.01 85.22 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.327 0.651 . . . . 0.0 111.456 -174.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.495 ' H ' ' CD1' ' A' ' 53' ' ' ILE . 0.9 OUTLIER -62.37 -53.99 40.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 N-CA-C 105.868 -1.901 . . . . 0.0 105.868 -179.193 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 75.1 t -57.15 -41.19 77.36 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.606 0 CA-C-O 118.035 -0.983 . . . . 0.0 110.498 177.494 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.6 mmmt -58.18 -51.7 68.66 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 120.167 1.349 . . . . 0.0 110.192 176.523 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 49.5 mt -55.73 -43.77 76.9 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 119.162 -0.447 . . . . 0.0 110.925 179.474 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 22.1 mmt -67.15 -60.75 2.35 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 118.807 0.73 . . . . 0.0 109.624 178.466 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -42.73 -45.56 4.8 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 126.746 2.018 . . . . 0.0 111.213 -178.691 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -39.41 -47.79 1.84 Allowed 'General case' 0 C--O 1.234 0.252 0 C-N-CA 124.578 1.151 . . . . 0.0 112.36 178.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -57.99 -48.22 80.64 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-O 119.456 -0.307 . . . . 0.0 110.345 -178.356 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -71.02 -49.05 49.26 Favored 'General case' 0 C--O 1.227 -0.126 0 CA-C-N 118.14 0.427 . . . . 0.0 110.335 -178.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 54.5 ttt85 . . . . . 0 N--CA 1.456 -0.175 0 C-N-CA 124.788 1.235 . . . . 0.0 110.613 -178.97 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 22.2 mp0 . . . . . 0 CA--C 1.533 0.323 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.2 m -108.39 149.44 11.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 169.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 17.9 p30 -88.69 170.66 10.61 Favored 'General case' 0 C--O 1.23 0.077 0 C-N-CA 124.325 1.05 . . . . 0.0 110.832 175.43 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -38.58 -61.42 0.71 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.83 1.252 . . . . 0.0 113.74 174.346 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 40.8 tp60 -62.66 -38.75 91.54 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 120.025 1.284 . . . . 0.0 110.669 -174.433 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.85 -33.5 75.98 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.888 -0.507 . . . . 0.0 110.947 176.956 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -61.18 -53.27 59.11 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 118.841 0.746 . . . . 0.0 109.182 168.679 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 24.2 mm -52.24 -42.54 37.0 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 C-N-CA 122.844 0.458 . . . . 0.0 110.097 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 34.0 m -54.17 -37.76 64.81 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.049 0.54 . . . . 0.0 111.378 177.905 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -57.34 -50.18 73.78 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 176.026 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 51.5 mt -65.63 -43.65 88.86 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.186 0.595 . . . . 0.0 111.329 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.63 -43.41 97.97 Favored Glycine 0 CA--C 1.529 0.919 0 N-CA-C 110.945 -0.862 . . . . 0.0 110.945 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.81 -49.84 73.35 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 123.095 0.558 . . . . 0.0 110.383 175.622 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 16.4 tp -47.37 -56.48 6.81 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.401 0.619 . . . . 0.0 109.948 173.436 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.96 -53.57 39.77 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.555 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 9.2 mtm -57.46 -50.45 72.99 Favored 'General case' 0 N--CA 1.455 -0.203 0 O-C-N 123.327 0.392 . . . . 0.0 111.861 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 84.0 mt -63.41 -49.96 80.61 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-O 117.79 -1.1 . . . . 0.0 110.34 -174.139 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.467 0.4 OUTLIER -78.18 -40.36 37.97 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-N 120.256 1.389 . . . . 0.0 113.504 -178.508 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.0 m-80 -82.53 67.22 8.49 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 169.514 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 90.2 mt-10 -41.37 -42.64 2.29 Favored 'General case' 0 N--CA 1.461 0.099 0 C-N-CA 125.281 1.432 . . . . 0.0 112.12 -172.181 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -31.42 -52.75 0.22 Allowed 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 126.561 1.944 . . . . 0.0 113.372 171.644 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 63.8 mt . . . . . 0 C--O 1.224 -0.256 0 C-N-CA 123.717 0.807 . . . . 0.0 113.103 -175.157 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.274 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.3 m -57.54 165.91 1.99 Allowed Pre-proline 0 CA--C 1.537 0.477 0 C-N-CA 125.082 1.353 . . . . 0.0 111.109 179.232 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 99.1 Cg_exo -45.45 -47.53 12.96 Favored 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 123.524 2.816 . . . . 0.0 113.477 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.9 mt -54.39 -55.53 27.7 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-N 117.817 0.28 . . . . 0.0 111.435 173.422 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -59.43 -39.67 84.27 Favored 'General case' 0 C--O 1.225 -0.22 0 N-CA-C 110.385 -0.228 . . . . 0.0 110.385 -176.021 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 12.4 tp-100 -63.37 -50.41 70.04 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.507 0.723 . . . . 0.0 110.501 177.648 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.28 -45.03 93.34 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.313 0.645 . . . . 0.0 111.095 -178.726 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 72.7 mt -53.14 -53.23 23.79 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 N-CA-C 108.107 -1.071 . . . . 0.0 108.107 169.647 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.43 -45.86 16.82 Favored Glycine 0 CA--C 1.526 0.751 0 C-N-CA 125.69 1.614 . . . . 0.0 112.176 175.328 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.7 mt -57.87 -55.99 27.8 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 117.751 0.776 . . . . 0.0 110.97 173.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.6 mp -58.69 -43.02 89.85 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.18 0.9 . . . . 0.0 111.608 -179.045 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 75.0 mt -54.12 -57.23 6.34 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 C-N-CA 124.09 0.956 . . . . 0.0 109.981 171.903 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.02 -50.44 58.91 Favored Glycine 0 CA--C 1.522 0.497 0 N-CA-C 110.249 -1.14 . . . . 0.0 110.249 -176.019 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 13.9 mm -51.56 -50.28 30.55 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 C-N-CA 123.523 0.729 . . . . 0.0 110.04 175.075 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -56.9 -57.72 11.26 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.252 178.727 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -56.72 -38.44 72.35 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.843 0.857 . . . . 0.0 111.139 -174.832 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -46.09 -39.14 8.93 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.601 1.161 . . . . 0.0 111.571 -179.342 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -107.2 -52.01 2.83 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 122.542 0.337 . . . . 0.0 110.11 178.341 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 5.6 m . . . . . 0 CA--C 1.527 0.081 0 C-N-CA 123.573 0.749 . . . . 0.0 111.981 -177.01 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 19.9 t-160 . . . . . 0 N--CA 1.452 -0.347 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 56.9 p -125.58 157.94 35.88 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 125.162 1.385 . . . . 0.0 111.968 -172.423 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.88 178.44 9.4 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 125.372 1.469 . . . . 0.0 107.703 168.109 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 4.3 m -135.5 173.31 11.86 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.412 0.685 . . . . 0.0 112.793 -170.79 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 37.2 ttmt -19.52 -68.86 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 130.44 3.496 . . . . 0.0 113.824 175.694 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 3.0 tppp? -56.08 -53.55 55.67 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.586 0.755 . . . . 0.0 109.959 -175.304 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -57.04 -41.71 79.15 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 123.516 0.726 . . . . 0.0 110.989 178.524 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 39.4 mt -61.47 -50.05 74.33 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 118.478 0.581 . . . . 0.0 111.212 178.507 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -59.55 -47.7 84.51 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 179.227 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -50.71 -55.91 14.42 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.314 0.646 . . . . 0.0 111.403 171.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 3.1 mt -45.43 -65.25 0.56 Allowed 'General case' 0 CA--C 1.521 -0.151 0 C-N-CA 124.514 1.126 . . . . 0.0 110.994 176.762 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 14.8 tt -61.19 -47.61 92.75 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 C-N-CA 120.056 -0.658 . . . . 0.0 109.827 -173.124 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -53.94 -50.12 67.16 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.016 0.926 . . . . 0.0 111.866 -178.948 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 50.9 mtmt -76.21 -49.48 17.04 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 122.359 0.264 . . . . 0.0 111.076 -176.082 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -78.02 -32.44 51.04 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 118.533 -0.746 . . . . 0.0 112.795 -169.215 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 48.7 mt . . . . . 0 C--N 1.338 0.089 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 169.013 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 . . . . . 0 C--O 1.226 -0.149 0 N-CA-C 113.886 1.069 . . . . 0.0 113.886 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -30.3 -55.7 0.19 Allowed 'General case' 0 C--O 1.227 -0.102 0 C-N-CA 125.907 1.683 . . . . 0.0 113.695 178.038 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -66.1 -42.17 89.63 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 121.069 0.461 . . . . 0.0 110.701 -174.16 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 53' ' ' ILE . . . . . 0.558 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.1 mp -61.26 -52.97 55.22 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 N-CA-C 106.636 -1.616 . . . . 0.0 106.636 179.292 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 69.9 t -57.08 -43.72 81.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 C-N-CA 124.362 1.065 . . . . 0.0 110.233 -178.882 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -55.92 -54.78 40.56 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 119.418 1.008 . . . . 0.0 110.497 172.807 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 43.5 mt -53.36 -42.09 66.49 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 119.04 -0.505 . . . . 0.0 111.359 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 22.9 mmt -68.76 -61.86 1.63 Allowed 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 118.741 0.701 . . . . 0.0 109.613 177.038 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -40.94 -46.98 2.92 Favored 'General case' 0 CA--C 1.516 -0.333 0 C-N-CA 127.626 2.37 . . . . 0.0 111.113 -177.455 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -39.71 -49.22 2.26 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.071 0.949 . . . . 0.0 112.513 177.377 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 10.0 mp -59.74 -56.02 27.05 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -177.268 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -61.27 -40.87 95.7 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 123.444 0.698 . . . . 0.0 111.245 -178.271 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 52.5 ttt180 -62.94 -50.54 70.4 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 124.035 0.934 . . . . 0.0 109.798 -178.559 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 . . . . . 0 C--O 1.227 -0.082 0 N-CA-C 110.586 -0.153 . . . . 0.0 110.586 -176.2 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 . . . . . 0 N--CA 1.453 -0.311 0 N-CA-C 110.378 -0.23 . . . . 0.0 110.378 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 12.0 m -115.67 148.03 18.67 Favored 'Isoleucine or valine' 0 C--O 1.235 0.303 0 N-CA-C 107.062 -1.459 . . . . 0.0 107.062 168.712 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -89.39 177.6 6.54 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.542 0.737 . . . . 0.0 111.287 175.251 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -47.35 -60.02 2.8 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.623 0.769 . . . . 0.0 111.94 175.398 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 40.3 tp60 -58.9 -37.93 77.75 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 119.218 0.917 . . . . 0.0 111.264 -176.029 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -63.26 -42.79 99.18 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.502 -0.749 . . . . 0.0 111.032 176.0 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -55.67 -48.59 74.79 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.64 -0.663 . . . . 0.0 109.915 170.54 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 28.0 mm -59.05 -32.47 47.89 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 O-C-N 121.601 -0.687 . . . . 0.0 110.76 175.589 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 23.4 m -66.37 -41.75 88.99 Favored 'General case' 0 C--O 1.225 -0.189 0 O-C-N 121.265 -0.897 . . . . 0.0 109.822 174.237 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -56.3 -52.92 62.74 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 174.864 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 49.2 mt -60.07 -46.13 90.59 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 120.933 0.397 . . . . 0.0 111.664 177.35 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.28 -39.2 97.58 Favored Glycine 0 CA--C 1.525 0.662 0 N-CA-C 110.948 -0.861 . . . . 0.0 110.948 -176.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.33 -47.14 77.54 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.431 0.692 . . . . 0.0 110.175 174.132 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 14.5 tp -51.33 -54.36 27.03 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 175.555 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.83 -57.33 9.65 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 114.872 -1.058 . . . . 0.0 109.995 177.532 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 49.5 ttm -48.09 -51.14 25.74 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.785 0.834 . . . . 0.0 110.755 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 33.6 mt -69.91 -48.49 63.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-O 117.859 -1.067 . . . . 0.0 111.201 -172.318 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.426 0.0 OUTLIER -87.99 -34.74 17.94 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 115.157 1.54 . . . . 0.0 115.157 -176.593 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 33.4 m120 -80.0 68.6 6.16 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 172.881 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -33.55 -43.79 0.13 Allowed 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 127.725 2.41 . . . . 0.0 114.364 -174.136 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -40.5 -41.5 1.44 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.572 1.549 . . . . 0.0 113.038 176.266 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 96.0 mt . . . . . 0 CA--C 1.532 0.281 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -179.085 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.215 0 CA-C-O 120.889 0.376 . . . . 0.0 110.892 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -54.86 161.57 2.25 Favored Pre-proline 0 CA--C 1.542 0.636 0 C-N-CA 124.012 0.925 . . . . 0.0 111.093 173.192 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -48.94 -49.26 15.59 Favored 'Trans proline' 0 N--CA 1.458 -0.592 0 C-N-CA 123.009 2.472 . . . . 0.0 112.424 177.442 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 5' ' ' LEU . 6.6 mt -58.45 -45.54 88.35 Favored 'General case' 0 C--O 1.223 -0.309 0 CA-C-O 118.985 -0.531 . . . . 0.0 111.013 175.484 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -57.86 -46.09 85.33 Favored 'General case' 0 C--O 1.227 -0.111 0 CA-C-N 118.771 0.714 . . . . 0.0 109.758 -178.601 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 12.5 tp60 -61.17 -49.07 78.71 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 122.05 0.14 . . . . 0.0 111.052 177.142 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.12 -46.91 79.06 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 121.503 0.668 . . . . 0.0 111.474 -175.637 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 76.9 mt -53.74 -53.56 25.53 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.233 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 170.406 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -45.96 -47.41 14.53 Favored Glycine 0 CA--C 1.528 0.857 0 C-N-CA 124.78 1.181 . . . . 0.0 111.807 175.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.2 mt -55.94 -57.18 13.2 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.22 0.608 . . . . 0.0 110.963 173.34 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.5 mp -57.44 -43.78 84.17 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.26 0.937 . . . . 0.0 111.899 -178.786 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 63.6 mt -55.01 -57.93 5.61 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 C-N-CA 123.627 0.771 . . . . 0.0 109.814 172.833 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -53.72 -49.95 55.93 Favored Glycine 0 CA--C 1.522 0.518 0 N-CA-C 110.411 -1.076 . . . . 0.0 110.411 -176.254 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 11.7 mm -52.62 -49.59 44.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 C-N-CA 123.581 0.752 . . . . 0.0 110.318 175.247 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -56.72 -57.42 12.5 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 118.307 0.503 . . . . 0.0 110.147 177.752 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -59.18 -37.09 76.54 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 123.549 0.74 . . . . 0.0 111.388 -172.763 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -46.64 -40.84 13.76 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 124.738 1.215 . . . . 0.0 111.41 178.22 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -96.55 -59.44 1.82 Allowed 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 176.686 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.4 m . . . . . 0 CA--C 1.527 0.082 0 C-N-CA 123.984 0.914 . . . . 0.0 112.273 -171.752 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.2 p . . . . . 0 N--CA 1.451 -0.416 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.34 178.61 9.42 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 125.471 1.509 . . . . 0.0 107.38 168.532 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 7.3 t -134.39 -168.5 2.15 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.462 1.028 . . . . 0.0 113.675 -174.284 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 21.2 pttt -48.81 -53.3 19.77 Favored 'General case' 0 C--O 1.228 -0.06 0 C-N-CA 126.146 1.778 . . . . 0.0 115.001 -168.702 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -54.05 -47.69 71.36 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 118.795 0.725 . . . . 0.0 109.961 179.512 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -63.03 -39.93 96.21 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 123.281 0.632 . . . . 0.0 110.79 178.718 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.1 mp -61.6 -49.08 78.03 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.901 0.773 . . . . 0.0 112.192 174.128 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -56.02 -47.79 77.16 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 176.62 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -54.78 -57.04 13.13 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-O 119.148 -0.453 . . . . 0.0 111.168 173.232 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.6 mt -46.42 -60.49 2.31 Favored 'General case' 0 C--N 1.333 -0.136 0 C-N-CA 123.836 0.854 . . . . 0.0 110.333 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 13.5 tt -62.72 -50.86 78.03 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 C-N-CA 120.44 -0.504 . . . . 0.0 109.879 -176.034 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -59.94 -47.42 85.85 Favored 'General case' 0 CA--C 1.537 0.471 0 O-C-N 121.152 -0.967 . . . . 0.0 112.235 -175.537 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -76.13 -55.93 5.13 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.819 -0.551 . . . . 0.0 109.707 -177.356 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -84.77 -19.38 32.68 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 -168.194 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 30.3 mt . . . . . 0 N--CA 1.461 0.096 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 169.328 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.0 t70 . . . . . 0 CA--C 1.521 -0.137 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -36.13 -58.99 0.64 Allowed 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 125.078 1.351 . . . . 0.0 112.581 -179.504 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 87.7 tt0 -61.4 -39.76 91.89 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.942 0.897 . . . . 0.0 111.388 -176.42 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.467 ' H ' ' CD1' ' A' ' 53' ' ' ILE . 0.9 OUTLIER -65.2 -54.58 27.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 106.45 -1.685 . . . . 0.0 106.45 -176.552 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 78.5 t -56.76 -42.18 76.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.046 177.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.8 mptp? -55.89 -54.31 46.24 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 119.091 0.86 . . . . 0.0 110.607 175.519 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 27.5 mt -53.26 -39.3 63.78 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 119.369 -0.348 . . . . 0.0 111.503 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.89 -62.66 1.42 Allowed 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 118.537 0.608 . . . . 0.0 110.078 177.208 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -43.33 -40.14 3.45 Favored 'General case' 0 CA--C 1.523 -0.074 0 C-N-CA 127.062 2.145 . . . . 0.0 111.987 -178.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -39.81 -47.82 2.17 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.303 1.041 . . . . 0.0 112.736 173.307 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.8 mp -66.49 -34.15 77.28 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 122.898 0.479 . . . . 0.0 110.901 -179.011 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -74.41 -51.93 13.56 Favored 'General case' 0 N--CA 1.456 -0.128 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 -179.188 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 17.4 mtp85 . . . . . 0 CA--C 1.531 0.241 0 C-N-CA 123.624 0.77 . . . . 0.0 109.231 170.101 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 . . . . . 0 N--CA 1.45 -0.47 0 N-CA-C 105.11 -2.182 . . . . 0.0 105.11 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 11.6 m -86.34 135.59 24.73 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 -178.693 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -79.8 171.03 15.67 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 123.731 0.812 . . . . 0.0 111.027 176.523 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -42.51 -59.52 1.85 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.502 0.721 . . . . 0.0 112.831 176.065 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.2 tp60 -63.85 -33.52 75.87 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 120.9 -1.125 . . . . 0.0 111.113 -175.82 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -64.81 -41.84 95.47 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 121.385 -0.822 . . . . 0.0 110.779 174.749 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -55.94 -50.59 70.35 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.414 -0.804 . . . . 0.0 109.38 170.242 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.1 mm -56.66 -37.94 55.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 O-C-N 121.922 -0.486 . . . . 0.0 110.451 176.143 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 33.2 m -62.63 -39.44 93.85 Favored 'General case' 0 C--O 1.226 -0.137 0 CA-C-N 118.95 0.796 . . . . 0.0 110.013 176.88 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -55.19 -53.97 49.22 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 173.004 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 53.5 mt -60.91 -45.16 95.74 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 122.04 -0.413 . . . . 0.0 112.017 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.35 -45.34 91.08 Favored Glycine 0 CA--C 1.524 0.616 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 -176.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.51 -45.51 92.66 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 117.691 0.745 . . . . 0.0 110.187 175.397 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 12.7 tp -51.87 -56.02 16.55 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 118.488 0.585 . . . . 0.0 109.786 174.743 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.06 -53.32 34.86 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.332 1.053 . . . . 0.0 110.669 178.381 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 44.6 ttm -55.55 -50.76 69.18 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 125.082 1.353 . . . . 0.0 110.757 -179.05 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 62.8 mt -65.92 -53.34 39.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-O 118.454 -0.784 . . . . 0.0 110.265 -175.736 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.473 0.1 OUTLIER -74.54 -37.55 63.01 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-N 119.739 1.154 . . . . 0.0 113.126 -176.057 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 25.0 m-80 -82.66 61.55 5.82 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 168.653 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.71 -37.06 3.46 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.88 1.272 . . . . 0.0 112.332 -174.518 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -31.96 -48.36 0.16 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 127.699 2.4 . . . . 0.0 113.306 169.421 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 46.2 mt . . . . . 0 CA--C 1.529 0.148 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 -177.193 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.227 0 CA-C-O 121.779 0.8 . . . . 0.0 110.746 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 10.5 m -62.76 163.5 15.62 Favored Pre-proline 0 CA--C 1.538 0.484 0 C-N-CA 125.871 1.668 . . . . 0.0 109.206 178.661 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -48.14 -48.33 16.92 Favored 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 122.921 2.414 . . . . 0.0 113.006 -176.521 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.8 mt -53.73 -52.54 59.81 Favored 'General case' 0 C--O 1.225 -0.192 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 172.363 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -61.57 -38.74 88.62 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-N 118.063 0.392 . . . . 0.0 110.565 -176.147 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.2 tp-100 -62.82 -50.9 69.16 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.291 0.636 . . . . 0.0 110.213 176.643 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.67 -45.93 91.89 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.44 0.638 . . . . 0.0 111.193 -179.339 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 67.4 mt -53.44 -51.24 43.33 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 170.359 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -48.59 -47.73 29.38 Favored Glycine 0 CA--C 1.525 0.713 0 C-N-CA 125.359 1.456 . . . . 0.0 111.619 175.861 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 mt -54.88 -55.21 32.95 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 117.525 0.662 . . . . 0.0 110.651 173.137 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -57.07 -43.6 82.26 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.007 0.822 . . . . 0.0 111.616 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 94.6 mt -56.07 -55.55 17.76 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 C-N-CA 123.487 0.715 . . . . 0.0 110.091 173.765 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.09 -48.49 73.52 Favored Glycine 0 CA--C 1.523 0.588 0 N-CA-C 110.802 -0.919 . . . . 0.0 110.802 -178.027 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.5 mm -53.58 -47.53 60.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 C-N-CA 123.183 0.593 . . . . 0.0 110.011 175.416 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -56.36 -57.37 12.55 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.476 0.58 . . . . 0.0 109.543 175.048 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -52.49 -40.17 62.06 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 125.491 1.516 . . . . 0.0 112.113 -173.276 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 65.0 tttp -50.96 -34.71 29.98 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.128 1.371 . . . . 0.0 111.467 176.886 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 71.5 m-85 -101.96 -60.89 1.46 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.615 0.766 . . . . 0.0 110.806 179.103 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 5.0 p . . . . . 0 C--O 1.224 -0.246 0 C-N-CA 123.335 0.654 . . . . 0.0 110.743 -174.528 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 9.5 t-80 . . . . . 0 C--O 1.235 0.313 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 4.8 p -136.58 162.46 33.06 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.898 0.879 . . . . 0.0 112.89 -168.195 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -161.34 174.24 13.81 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.695 1.198 . . . . 0.0 109.255 168.103 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -115.41 171.83 7.47 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.054 0.941 . . . . 0.0 112.832 -169.662 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 14.3 ptmt -35.93 -57.98 0.66 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 127.521 2.328 . . . . 0.0 114.414 179.295 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.17 -45.43 87.49 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 122.805 0.442 . . . . 0.0 110.118 -178.144 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -62.87 -39.42 94.39 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 123.299 0.64 . . . . 0.0 110.936 177.45 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 5.9 mt -61.41 -49.82 75.31 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 119.096 0.862 . . . . 0.0 111.849 173.118 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 89.3 mttt -55.52 -46.84 76.98 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 122.114 -0.366 . . . . 0.0 110.266 176.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -54.62 -55.06 33.4 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 118.856 -0.592 . . . . 0.0 110.915 173.325 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 8.3 mt -46.38 -61.38 1.82 Allowed 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.295 0.638 . . . . 0.0 110.43 179.133 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 18.4 tt -59.62 -54.5 33.71 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 119.916 -0.713 . . . . 0.0 110.156 -176.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -60.79 -46.11 91.79 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 118.606 0.639 . . . . 0.0 112.673 -173.404 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -74.8 -52.75 10.62 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.13 0.572 . . . . 0.0 109.626 -177.474 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 55.4 mm-40 -81.96 -27.52 33.21 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -167.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 41.0 mt . . . . . 0 CA--C 1.523 -0.083 0 N-CA-C 105.114 -2.18 . . . . 0.0 105.114 167.438 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 19.8 t70 . . . . . 0 CA--C 1.529 0.137 0 N-CA-C 115.367 1.617 . . . . 0.0 115.367 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.84 -60.97 0.16 Allowed 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 125.912 1.685 . . . . 0.0 113.35 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -66.15 -39.83 90.11 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 120.792 0.33 . . . . 0.0 110.954 -174.374 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 53' ' ' ILE . . . . . 0.478 ' H ' ' CD1' ' B' ' 53' ' ' ILE . 0.9 OUTLIER -61.06 -57.6 11.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 -177.937 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 52.5 t -57.77 -39.39 70.48 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 CA-C-N 115.01 -0.995 . . . . 0.0 110.187 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -56.17 -52.14 65.45 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 119.794 1.179 . . . . 0.0 111.229 174.726 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 68.1 mt -55.38 -40.54 71.48 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 119.345 -0.359 . . . . 0.0 111.205 -179.592 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.47 -60.69 2.1 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 118.839 0.745 . . . . 0.0 110.132 176.366 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -40.46 -46.13 2.37 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 127.369 2.268 . . . . 0.0 111.7 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -39.55 -48.23 2.02 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.449 1.1 . . . . 0.0 112.112 175.423 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 63.2 mt -57.9 -50.83 72.0 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.508 0.723 . . . . 0.0 110.017 -179.232 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -67.21 -41.16 86.23 Favored 'General case' 0 C--O 1.226 -0.15 0 C-N-CA 123.194 0.598 . . . . 0.0 111.067 -178.38 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 53.3 ttm-85 -60.01 -48.21 82.64 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.464 1.106 . . . . 0.0 109.977 -179.247 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 . . . . . 0 C--O 1.228 -0.051 0 CA-C-O 120.703 0.287 . . . . 0.0 111.316 -177.537 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 44.9 mp0 . . . . . 0 N--CA 1.451 -0.413 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 35.6 m -86.27 154.94 3.38 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 168.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 16.3 p30 -97.93 171.13 8.48 Favored 'General case' 0 CA--C 1.528 0.111 0 C-N-CA 124.797 1.239 . . . . 0.0 111.425 176.518 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -41.59 -60.98 1.16 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.402 1.081 . . . . 0.0 113.16 175.083 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 41.1 tp60 -63.51 -34.0 76.82 Favored 'General case' 0 C--O 1.225 -0.211 0 O-C-N 121.036 -1.04 . . . . 0.0 110.879 -175.431 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 54.7 mm-40 -63.01 -45.43 92.4 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 118.932 0.787 . . . . 0.0 111.17 173.225 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -53.67 -50.03 66.7 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.697 -0.627 . . . . 0.0 109.846 171.971 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 27.1 mm -58.01 -38.42 66.92 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 O-C-N 121.855 -0.528 . . . . 0.0 110.652 176.064 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 70.7 m -63.11 -41.71 99.4 Favored 'General case' 0 C--O 1.226 -0.174 0 O-C-N 121.506 -0.746 . . . . 0.0 109.972 176.609 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -56.37 -54.28 47.48 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 174.705 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 42.2 mt -58.82 -47.65 84.04 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 121.975 -0.453 . . . . 0.0 112.032 178.639 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.75 -43.94 97.02 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 110.87 -0.892 . . . . 0.0 110.87 -176.687 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.07 -48.26 79.42 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 121.988 -0.713 . . . . 0.0 110.205 176.374 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -49.56 -56.83 8.53 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-O 121.864 0.84 . . . . 0.0 109.88 173.837 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.94 -54.54 23.37 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 114.612 -1.176 . . . . 0.0 110.376 179.163 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 19.7 ttp -62.4 -45.57 92.52 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 123.596 0.758 . . . . 0.0 111.648 -177.165 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 75.4 mt -60.66 -47.88 91.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.012 -177.258 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.484 0.0 OUTLIER -82.45 -34.16 28.25 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 114.476 1.287 . . . . 0.0 114.476 -179.926 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -80.6 75.05 7.5 Favored 'General case' 0 N--CA 1.462 0.159 0 O-C-N 120.779 -1.201 . . . . 0.0 108.505 171.884 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -40.41 -37.99 0.76 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.834 1.654 . . . . 0.0 112.977 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -39.93 -42.3 1.32 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.527 1.531 . . . . 0.0 113.46 173.33 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 93.9 mt . . . . . 0 CA--C 1.533 0.319 0 C-N-CA 123.763 0.825 . . . . 0.0 113.029 -176.956 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.237 0 CA-C-O 121.222 0.534 . . . . 0.0 111.972 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -50.32 158.33 1.03 Allowed Pre-proline 0 CA--C 1.54 0.586 0 C-N-CA 124.702 1.201 . . . . 0.0 111.541 177.314 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_exo -44.67 -49.89 8.89 Favored 'Trans proline' 0 N--CA 1.46 -0.491 0 C-N-CA 123.501 2.801 . . . . 0.0 113.404 -179.542 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.407 HD23 ' HA ' ' A' ' 5' ' ' LEU . 6.2 mt -55.9 -48.96 74.71 Favored 'General case' 0 C--O 1.226 -0.164 0 O-C-N 122.427 -0.17 . . . . 0.0 111.316 174.874 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -59.77 -46.9 87.75 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -177.376 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 12.2 tp60 -59.92 -47.27 86.47 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 122.505 0.322 . . . . 0.0 110.736 177.744 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.59 -46.04 77.25 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.091 0.472 . . . . 0.0 111.412 -176.201 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 77.9 mt -54.2 -50.66 54.06 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 170.391 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.46 -48.14 22.14 Favored Glycine 0 CA--C 1.528 0.89 0 C-N-CA 124.966 1.27 . . . . 0.0 111.893 174.545 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.9 mt -55.52 -56.8 16.02 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 117.71 0.755 . . . . 0.0 110.553 174.232 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.6 mp -57.98 -43.46 86.56 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 119.018 0.826 . . . . 0.0 111.752 -178.108 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 73.5 mt -55.48 -56.53 11.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 C-N-CA 124.03 0.932 . . . . 0.0 110.356 173.255 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.58 -49.33 65.74 Favored Glycine 0 CA--C 1.523 0.542 0 N-CA-C 110.544 -1.022 . . . . 0.0 110.544 -177.692 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 8.7 mm -54.03 -48.44 64.39 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 C-N-CA 123.674 0.79 . . . . 0.0 110.148 176.099 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -54.98 -61.4 2.33 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 118.45 0.568 . . . . 0.0 109.525 176.036 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -53.42 -39.32 64.27 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.583 0.753 . . . . 0.0 111.633 -174.169 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -50.64 -36.77 37.01 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.842 0.857 . . . . 0.0 111.734 178.161 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -101.12 -53.37 3.04 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.306 0.642 . . . . 0.0 110.028 -178.474 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 CA--C 1.529 0.144 0 O-C-N 121.322 -0.861 . . . . 0.0 111.907 179.993 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 48.0 p . . . . . 0 N--CA 1.453 -0.314 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -154.79 159.04 40.35 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 122.631 0.372 . . . . 0.0 111.463 169.617 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 81.0 p -103.38 167.12 10.01 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.782 0.833 . . . . 0.0 112.936 -169.837 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.0 pttm -32.98 -48.69 0.21 Allowed 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 127.158 2.183 . . . . 0.0 113.987 170.797 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.5 tmmm? -60.1 -52.23 66.25 Favored 'General case' 0 N--CA 1.453 -0.311 0 O-C-N 121.969 -0.457 . . . . 0.0 109.9 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -61.08 -36.35 79.41 Favored 'General case' 0 C--O 1.223 -0.311 0 CA-C-O 119.346 -0.359 . . . . 0.0 110.776 178.092 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 48.6 mt -67.99 -49.9 58.86 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.575 0.625 . . . . 0.0 111.659 179.498 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp -60.46 -39.71 88.56 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 121.912 -0.493 . . . . 0.0 109.972 176.954 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -56.88 -63.96 1.03 Allowed 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 169.07 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.7 mt -39.49 -58.64 1.23 Allowed 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 125.212 1.405 . . . . 0.0 112.266 -178.784 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 16.0 tt -58.61 -51.37 72.63 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 -177.736 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -59.26 -42.01 90.15 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 120.995 -1.065 . . . . 0.0 112.718 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.1 mmpt? -77.7 -49.53 14.27 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 125.256 1.423 . . . . 0.0 110.694 -170.913 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -102.77 -24.05 13.75 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.914 1.286 . . . . 0.0 112.709 -168.803 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 69.5 mt . . . . . 0 CA--C 1.527 0.064 0 N-CA-C 107.384 -1.339 . . . . 0.0 107.384 169.025 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 . . . . . 0 N--CA 1.462 0.173 0 N-CA-C 113.808 1.04 . . . . 0.0 113.808 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.27 -54.89 0.14 Allowed 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.948 1.699 . . . . 0.0 113.357 177.038 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 74.4 tt0 -67.29 -42.98 82.86 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.482 0.658 . . . . 0.0 111.031 -175.382 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.456 ' N ' HD12 ' A' ' 53' ' ' ILE . 1.1 mp -62.22 -50.6 79.33 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 N-CA-C 106.565 -1.643 . . . . 0.0 106.565 -178.242 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 77.1 t -54.09 -56.25 10.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 N-CA-C 109.09 -0.708 . . . . 0.0 109.09 176.422 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.9 mptt -45.23 -52.54 9.38 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 123.235 0.614 . . . . 0.0 112.317 -179.616 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 15.3 mt -50.07 -42.31 49.68 Favored 'General case' 0 CA--C 1.535 0.378 0 O-C-N 123.194 0.309 . . . . 0.0 111.815 -179.068 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 1.2 mpp? -81.39 -66.15 0.92 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.694 0.798 . . . . 0.0 109.642 179.149 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -40.29 -37.73 0.69 Allowed 'General case' 0 N--CA 1.461 0.093 0 C-N-CA 127.503 2.321 . . . . 0.0 112.789 -178.222 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -38.45 -53.37 1.55 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.939 0.896 . . . . 0.0 112.124 172.625 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -60.51 -37.1 80.04 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 110.564 -0.162 . . . . 0.0 110.564 -175.651 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -73.82 -51.53 16.03 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.624 0.77 . . . . 0.0 109.83 -177.139 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.534 0.35 0 CA-C-O 120.435 0.159 . . . . 0.0 111.001 -177.485 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 51.6 mp0 . . . . . 0 N--CA 1.451 -0.383 0 N-CA-C 105.429 -2.063 . . . . 0.0 105.429 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.0 m -79.05 138.03 20.78 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 -169.707 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -79.82 171.89 14.51 Favored 'General case' 0 C--O 1.231 0.113 0 C-N-CA 122.685 0.394 . . . . 0.0 110.577 176.465 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -43.95 -56.93 3.61 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.623 0.769 . . . . 0.0 112.673 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 34.8 tp60 -63.73 -33.71 76.25 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 120.968 -1.083 . . . . 0.0 110.789 -176.025 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -66.62 -42.01 87.48 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 118.761 0.709 . . . . 0.0 110.641 176.358 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -54.69 -48.59 72.25 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 121.653 -0.654 . . . . 0.0 109.813 169.78 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.449 ' CG2' ' CG2' ' B' ' 74' ' ' ILE . 24.4 mm -62.51 -29.75 47.56 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 O-C-N 121.828 -0.545 . . . . 0.0 111.275 175.98 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 39.1 m -68.23 -43.7 77.35 Favored 'General case' 0 C--O 1.225 -0.205 0 O-C-N 120.922 -1.112 . . . . 0.0 109.496 173.739 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 58.1 t80 -56.28 -58.06 9.6 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 175.774 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 71.1 mt -61.3 -44.48 97.15 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 122.101 -0.374 . . . . 0.0 111.79 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.78 -44.03 95.37 Favored Glycine 0 CA--C 1.527 0.811 0 N-CA-C 111.071 -0.812 . . . . 0.0 111.071 -176.704 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.12 -47.92 75.46 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 117.798 0.799 . . . . 0.0 109.938 176.835 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 37.6 tp -47.11 -57.31 5.23 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 121.786 0.803 . . . . 0.0 110.226 172.917 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -53.38 -49.51 67.06 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 114.633 -1.167 . . . . 0.0 110.904 177.901 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 44.9 ttm -57.68 -51.23 70.37 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.171 0.988 . . . . 0.0 110.689 -179.156 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 65.4 mt -61.32 -50.71 79.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-O 118.287 -0.863 . . . . 0.0 109.577 -176.725 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.431 1.7 p90 -72.89 -40.79 65.3 Favored 'General case' 0 C--N 1.347 0.469 0 C-N-CA 118.818 -1.153 . . . . 0.0 113.301 -177.464 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 43.7 m-80 -78.81 74.85 5.33 Favored 'General case' 0 N--CA 1.462 0.135 0 O-C-N 121.077 -1.015 . . . . 0.0 108.634 172.407 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -39.56 -41.55 1.03 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.525 1.53 . . . . 0.0 113.074 -179.187 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -38.37 -46.41 1.12 Allowed 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.349 1.46 . . . . 0.0 112.885 173.114 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.0 mt . . . . . 0 CA--C 1.534 0.348 0 C-N-CA 124.315 1.046 . . . . 0.0 113.367 -175.715 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.249 0 CA-C-O 120.739 0.304 . . . . 0.0 110.633 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 2.9 m -52.83 159.41 1.81 Allowed Pre-proline 0 CA--C 1.542 0.655 0 C-N-CA 123.56 0.744 . . . . 0.0 110.976 171.609 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -49.02 -50.08 13.66 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 123.067 2.512 . . . . 0.0 113.099 -177.255 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.3 mt -55.56 -45.07 77.33 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 173.117 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -64.21 -38.57 91.52 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 118.35 0.523 . . . . 0.0 109.868 -176.877 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 14.2 tp60 -64.43 -46.75 81.87 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.542 0.337 . . . . 0.0 110.838 174.345 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.39 -47.87 80.24 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.539 0.685 . . . . 0.0 110.989 -178.638 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 74.6 mt -53.35 -51.95 36.19 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 169.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.66 -43.48 21.99 Favored Glycine 0 CA--C 1.526 0.773 0 C-N-CA 125.717 1.627 . . . . 0.0 112.109 175.857 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 mt -59.38 -54.15 50.04 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 117.704 0.752 . . . . 0.0 110.598 173.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.7 mp -58.23 -43.66 87.85 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 118.814 0.734 . . . . 0.0 111.341 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 76.3 mt -56.03 -55.93 15.63 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.157 0 C-N-CA 123.825 0.85 . . . . 0.0 109.921 173.67 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -53.97 -50.61 54.22 Favored Glycine 0 CA--C 1.521 0.445 0 N-CA-C 110.023 -1.231 . . . . 0.0 110.023 -177.38 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 8.6 mm -53.0 -48.88 51.55 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 C-N-CA 123.508 0.723 . . . . 0.0 110.586 175.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -57.24 -60.99 2.79 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.949 0.404 . . . . 0.0 109.953 177.296 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -52.07 -40.63 61.48 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 125.418 1.487 . . . . 0.0 111.564 -174.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -46.36 -34.6 4.72 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.538 1.535 . . . . 0.0 111.623 179.314 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 85.4 m-85 -110.71 -50.15 2.98 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 122.817 0.447 . . . . 0.0 110.786 177.274 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 12.4 p . . . . . 0 C--O 1.227 -0.104 0 C-N-CA 123.427 0.691 . . . . 0.0 111.126 -174.56 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 17.7 p-80 . . . . . 0 CA--C 1.536 0.412 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 32.6 p -132.49 164.41 26.64 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 123.947 0.899 . . . . 0.0 109.739 176.333 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -160.21 167.21 28.12 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.771 0.428 . . . . 0.0 110.936 169.736 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 46.7 m -113.71 170.09 8.5 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.923 1.289 . . . . 0.0 113.449 -169.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -32.2 -52.23 0.27 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 128.299 2.64 . . . . 0.0 115.265 178.375 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -59.03 -59.29 5.7 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -178.886 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -52.48 -39.88 61.69 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 123.521 0.728 . . . . 0.0 111.37 177.052 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 54.3 mt -65.05 -51.31 62.25 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 118.8 0.727 . . . . 0.0 112.079 179.5 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 8.2 mtmp? -61.77 -45.3 94.48 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 121.662 -0.649 . . . . 0.0 109.908 178.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -49.93 -56.91 8.74 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.45 0.7 . . . . 0.0 110.512 169.94 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 4.1 mt -45.5 -61.79 1.54 Allowed 'General case' 0 CA--C 1.521 -0.173 0 C-N-CA 124.351 1.06 . . . . 0.0 110.416 177.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 2.8 tp -60.55 -49.25 85.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 -173.376 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 -55.17 -48.55 73.62 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.302 1.041 . . . . 0.0 111.838 -178.463 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 8.5 mtmp? -76.66 -53.11 8.45 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 120.914 0.388 . . . . 0.0 111.264 -176.311 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -78.89 -26.47 43.86 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -167.835 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 49.9 mt . . . . . 0 N--CA 1.456 -0.132 0 N-CA-C 106.438 -1.69 . . . . 0.0 106.438 167.632 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 . . . . . 0 C--O 1.225 -0.235 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.84 -59.69 0.17 Allowed 'General case' 0 CA--C 1.527 0.096 0 C-N-CA 125.882 1.673 . . . . 0.0 113.732 178.842 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 74.1 tt0 -65.86 -38.44 88.83 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.742 0.306 . . . . 0.0 110.695 -173.948 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 53' ' ' ILE . . . . . 0.524 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.1 mp -63.5 -53.43 45.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 N-CA-C 106.893 -1.521 . . . . 0.0 106.893 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 78.8 t -56.02 -44.36 78.19 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 C-N-CA 124.226 1.011 . . . . 0.0 110.04 179.606 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -56.1 -53.91 51.38 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 118.779 0.718 . . . . 0.0 110.759 173.117 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 66.6 mt -53.56 -41.29 66.33 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 119.082 -0.485 . . . . 0.0 111.374 178.84 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 25.9 mmt -67.57 -61.36 1.93 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.896 0.771 . . . . 0.0 109.646 176.472 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -42.8 -43.88 4.19 Favored 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 127.441 2.296 . . . . 0.0 111.437 -177.731 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -39.64 -48.66 2.14 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.397 1.079 . . . . 0.0 112.302 176.115 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 10.2 mp -63.02 -48.59 78.11 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 -176.947 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -62.83 -45.32 93.17 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 122.825 0.45 . . . . 0.0 110.606 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 45.4 ttm-85 -55.73 -51.95 65.59 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 123.6 0.76 . . . . 0.0 109.198 176.724 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 . . . . . 0 CA--C 1.53 0.203 0 C-N-CA 123.079 0.552 . . . . 0.0 110.586 -176.675 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 . . . . . 0 N--CA 1.453 -0.29 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 5.6 m -78.98 140.93 16.1 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 174.67 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 18.6 p30 -82.89 172.82 12.41 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 123.556 0.742 . . . . 0.0 110.902 175.806 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -44.34 -60.18 2.05 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.001 0.92 . . . . 0.0 112.56 176.049 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 50.4 tp60 -62.72 -35.51 79.98 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 119.381 0.991 . . . . 0.0 110.925 -175.26 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 57.9 mm-40 -60.82 -47.75 84.91 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 119.032 0.833 . . . . 0.0 111.094 173.54 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -53.25 -49.22 67.32 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 122.004 -0.435 . . . . 0.0 110.145 172.549 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 0.449 ' CG2' ' CG2' ' A' ' 74' ' ' ILE . 29.8 mm -57.83 -39.21 69.94 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 O-C-N 121.735 -0.603 . . . . 0.0 110.66 176.239 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 57.8 m -63.87 -41.09 97.83 Favored 'General case' 0 C--O 1.227 -0.125 0 O-C-N 121.587 -0.695 . . . . 0.0 110.106 177.88 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 32.0 t80 -54.32 -53.16 57.64 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 173.657 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 75.9 mt -62.4 -42.28 99.31 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 178.53 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.32 -42.39 94.07 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 110.718 -0.953 . . . . 0.0 110.718 -177.684 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.6 -46.76 88.45 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 123.41 0.684 . . . . 0.0 109.886 174.238 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 10.2 tp -51.51 -54.59 25.63 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 174.582 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -53.08 -52.5 58.38 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.899 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 28.8 mtt -50.7 -55.69 15.4 Favored 'General case' 0 CA--C 1.526 0.049 0 C-N-CA 123.825 0.85 . . . . 0.0 111.347 174.795 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 49.0 mt -63.12 -47.37 92.8 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.327 0 CA-C-O 118.105 -0.95 . . . . 0.0 110.433 -169.266 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.475 0.0 OUTLIER -83.48 -39.69 20.18 Favored 'General case' 0 C--N 1.347 0.463 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 179.818 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 16.4 m-80 -82.37 65.98 7.75 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 107.294 -1.373 . . . . 0.0 107.294 169.539 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -43.96 -37.86 3.15 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.543 1.137 . . . . 0.0 112.701 -174.836 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.27 -48.46 0.23 Allowed 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 127.024 2.13 . . . . 0.0 113.346 169.748 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 97.3 mt . . . . . 0 CA--C 1.528 0.104 0 N-CA-C 112.573 0.583 . . . . 0.0 112.573 -176.356 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.259 0 CA-C-O 120.506 0.193 . . . . 0.0 111.317 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.4 m -52.67 157.91 2.39 Favored Pre-proline 0 CA--C 1.534 0.353 0 C-N-CA 123.991 0.916 . . . . 0.0 110.266 172.183 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_exo -40.09 -52.03 2.98 Favored 'Trans proline' 0 N--CA 1.459 -0.511 0 C-N-CA 124.038 3.158 . . . . 0.0 113.82 -179.343 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 5' ' ' LEU . 5.6 mt -54.05 -60.41 3.36 Favored 'General case' 0 C--O 1.225 -0.207 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 173.773 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -55.77 -40.11 72.14 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-O 121.004 0.43 . . . . 0.0 110.708 -175.777 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -64.96 -51.63 60.72 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.356 1.062 . . . . 0.0 110.144 -179.625 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.05 -46.77 87.4 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.221 1.008 . . . . 0.0 110.901 178.453 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 69.1 mt -51.94 -55.07 10.83 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 170.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.23 -47.88 20.95 Favored Glycine 0 CA--C 1.527 0.834 0 C-N-CA 125.148 1.356 . . . . 0.0 112.033 176.372 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.9 mt -55.0 -53.43 55.85 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.612 0.765 . . . . 0.0 110.986 174.46 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -59.33 -45.0 92.54 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 121.582 -0.699 . . . . 0.0 111.792 179.454 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.479 HD11 ' HB1' ' B' ' 81' ' ' ALA . 83.9 mt -55.72 -55.6 16.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 C-N-CA 123.714 0.806 . . . . 0.0 109.819 175.177 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -52.74 -51.97 41.32 Favored Glycine 0 CA--C 1.521 0.447 0 N-CA-C 109.724 -1.35 . . . . 0.0 109.724 -177.893 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.44 HG21 HD11 ' B' ' 5' ' ' LEU . 3.2 mm -56.71 -47.31 82.7 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 CA-C-O 119.332 -0.366 . . . . 0.0 110.634 179.057 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.4 ' HB2' ' CE2' ' A' ' 73' ' ' TYR . 73.7 t80 -53.03 -60.44 3.29 Favored 'General case' 0 C--N 1.339 0.14 0 CA-C-N 118.126 0.421 . . . . 0.0 110.055 175.388 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -60.55 -34.69 74.52 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 118.987 -0.53 . . . . 0.0 111.19 -171.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.3 ttpp -52.72 -37.9 59.92 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.134 0.574 . . . . 0.0 111.442 -179.258 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -97.27 -58.48 2.0 Favored 'General case' 0 C--O 1.227 -0.116 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 175.377 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.8 t . . . . . 0 CA--C 1.533 0.303 0 C-N-CA 124.369 1.068 . . . . 0.0 111.733 -173.727 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 31.6 p . . . . . 0 N--CA 1.446 -0.63 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -158.43 177.55 11.13 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.816 1.247 . . . . 0.0 108.059 174.028 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 8.5 t -139.13 -169.46 2.66 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 119.861 1.209 . . . . 0.0 112.282 -175.281 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 41.9 pttt -41.44 -54.07 3.2 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 127.279 2.231 . . . . 0.0 113.61 -169.596 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -53.62 -51.94 61.47 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.064 0.546 . . . . 0.0 110.267 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 14.6 mp0 -64.92 -41.87 95.19 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 -178.463 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 41.8 mt -62.07 -47.38 84.91 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 118.544 0.611 . . . . 0.0 111.528 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -61.51 -49.94 74.72 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 176.377 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 78.3 tt0 -48.82 -54.89 13.32 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.168 0.987 . . . . 0.0 110.574 175.685 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.5 mt -48.41 -75.26 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 126.007 1.723 . . . . 0.0 109.022 174.68 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 15.6 tt -55.26 -47.05 78.16 Favored 'Isoleucine or valine' 0 C--N 1.341 0.235 0 CA-C-N 118.427 0.558 . . . . 0.0 111.268 -169.817 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.3 tt0 -52.23 -47.79 65.5 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 123.64 0.776 . . . . 0.0 111.37 -177.641 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 73.1 mttt -81.01 -62.58 1.62 Allowed 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 121.733 0.778 . . . . 0.0 109.506 -179.059 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -55.87 -36.33 67.47 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 114.842 -1.072 . . . . 0.0 111.882 -169.562 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 85.1 mt . . . . . 0 N--CA 1.452 -0.369 0 C-N-CA 124.842 1.257 . . . . 0.0 107.743 171.155 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 . . . . . 0 CA--C 1.528 0.11 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.84 -60.39 0.16 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.804 1.642 . . . . 0.0 114.1 -174.828 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -65.29 -42.68 92.89 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 122.958 0.503 . . . . 0.0 111.137 -175.538 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.545 HD12 ' H ' ' A' ' 53' ' ' ILE . 1.2 mp -60.01 -53.01 54.5 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 N-CA-C 106.876 -1.528 . . . . 0.0 106.876 -178.921 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 72.1 t -54.13 -55.35 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 CA-C-N 115.523 -0.762 . . . . 0.0 108.976 178.383 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -47.26 -54.48 10.78 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 118.489 0.586 . . . . 0.0 111.724 178.893 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 25.8 mt -51.55 -41.11 60.87 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 -177.255 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -80.79 -65.26 1.03 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.343 0.657 . . . . 0.0 110.37 178.698 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -37.91 -42.43 0.62 Allowed 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 127.38 2.272 . . . . 0.0 112.139 179.712 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -38.22 -49.27 1.36 Allowed 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 124.671 1.188 . . . . 0.0 112.546 175.65 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.8 pp -58.73 -41.68 87.02 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.459 0.572 . . . . 0.0 111.148 -175.345 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -75.66 -46.28 32.3 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 123.661 0.784 . . . . 0.0 109.967 -178.798 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 59.7 ttm-85 . . . . . 0 CA--C 1.529 0.159 0 C-N-CA 123.831 0.852 . . . . 0.0 110.291 176.495 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 . . . . . 0 N--CA 1.454 -0.245 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.6 m -79.65 145.63 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 172.678 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.9 p-10 -88.54 177.88 6.67 Favored 'General case' 0 C--O 1.231 0.086 0 C-N-CA 122.832 0.453 . . . . 0.0 110.825 175.192 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -42.6 -59.73 1.8 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.684 0.794 . . . . 0.0 112.241 172.906 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 61.6 tp60 -60.75 -37.0 80.34 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 119.294 0.952 . . . . 0.0 111.683 -175.51 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -67.97 -37.43 81.52 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.248 -0.908 . . . . 0.0 111.217 176.466 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.4 ' CE2' ' HB2' ' A' ' 16' ' ' PHE . 0.4 OUTLIER -58.0 -48.43 80.04 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.12 -0.988 . . . . 0.0 109.474 169.344 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 30.6 mm -58.76 -32.8 47.53 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 123.171 0.589 . . . . 0.0 110.497 175.558 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 56.0 m -69.86 -38.96 76.6 Favored 'General case' 0 C--O 1.225 -0.216 0 O-C-N 121.504 -0.747 . . . . 0.0 110.621 174.052 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -59.16 -55.73 31.28 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.56 0.618 . . . . 0.0 109.366 174.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 32.1 mt -56.8 -46.61 81.46 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 120.711 0.291 . . . . 0.0 110.931 175.081 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -58.18 -44.3 94.93 Favored Glycine 0 CA--C 1.525 0.673 0 C-N-CA 124.346 0.974 . . . . 0.0 111.448 -178.11 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.58 -47.43 69.75 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.45 0.7 . . . . 0.0 109.899 178.8 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -49.98 -54.3 20.86 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.446 0.641 . . . . 0.0 109.565 173.831 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -53.15 -55.57 23.07 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 124.702 1.201 . . . . 0.0 110.968 177.314 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 40.2 ttm -52.33 -52.12 54.96 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 124.775 1.23 . . . . 0.0 110.524 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 56.6 mt -62.81 -51.68 68.95 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-O 118.088 -0.958 . . . . 0.0 109.706 -172.674 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.427 0.0 OUTLIER -81.51 -32.31 32.42 Favored 'General case' 0 C--N 1.346 0.436 0 N-CA-C 114.667 1.358 . . . . 0.0 114.667 -176.392 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -80.36 76.48 7.17 Favored 'General case' 0 CA--C 1.521 -0.157 0 O-C-N 120.714 -1.242 . . . . 0.0 108.615 175.201 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -35.07 -49.83 0.48 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.522 1.529 . . . . 0.0 111.689 177.591 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -38.33 -43.78 0.84 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 126.893 2.077 . . . . 0.0 114.088 177.007 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 55.2 mt . . . . . 0 N--CA 1.456 -0.158 0 CA-C-O 119.432 -0.318 . . . . 0.0 111.339 -178.47 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.241 0 CA-C-O 121.137 0.494 . . . . 0.0 110.581 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 4.5 t -45.71 150.43 0.95 Allowed Pre-proline 0 CA--C 1.535 0.393 0 C-N-CA 124.292 1.037 . . . . 0.0 110.521 169.316 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo -43.56 -42.73 11.19 Favored 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 123.083 2.522 . . . . 0.0 112.097 168.596 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.44 HD11 HG21 ' A' ' 15' ' ' ILE . 5.0 mt -66.57 -43.06 86.0 Favored 'General case' 0 C--O 1.223 -0.331 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 174.134 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -57.07 -46.47 82.48 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 119.015 0.825 . . . . 0.0 109.407 177.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 -58.99 -52.73 64.49 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.57 0.748 . . . . 0.0 110.805 175.71 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.14 -46.76 85.73 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.301 0.64 . . . . 0.0 112.063 -175.57 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 73.9 mt -54.5 -53.21 32.95 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 N-CA-C 107.886 -1.154 . . . . 0.0 107.886 170.603 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.25 -46.27 15.99 Favored Glycine 0 CA--C 1.528 0.846 0 C-N-CA 124.64 1.114 . . . . 0.0 112.067 175.559 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 mt -58.23 -57.37 13.18 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.918 0.887 . . . . 0.0 110.918 174.843 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.07 -43.74 87.14 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.264 0.938 . . . . 0.0 111.669 -178.405 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 59.3 mt -56.35 -55.35 19.44 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.156 0 C-N-CA 123.623 0.769 . . . . 0.0 110.0 173.259 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.89 -49.15 63.28 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 110.566 -1.014 . . . . 0.0 110.566 -177.131 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 11.2 mm -53.06 -49.37 50.28 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 C-N-CA 123.454 0.701 . . . . 0.0 109.871 175.05 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 37.7 t80 -56.8 -52.43 65.07 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 121.805 -0.559 . . . . 0.0 110.768 176.733 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -58.57 -38.3 77.58 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 124.687 1.195 . . . . 0.0 111.106 -174.889 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 61.8 tttm -57.76 -25.82 60.99 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.933 1.293 . . . . 0.0 112.497 -179.352 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 56.2 m-85 -117.1 -62.22 1.61 Allowed 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.372 0.669 . . . . 0.0 109.903 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.332 -0.191 0 C-N-CA 124.164 0.985 . . . . 0.0 110.162 -176.6 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 12.9 t-80 . . . . . 0 CA--C 1.534 0.336 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -138.54 158.75 43.66 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 125.195 1.398 . . . . 0.0 111.316 -169.052 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.47 176.11 12.0 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 125.388 1.475 . . . . 0.0 108.212 171.397 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 7.3 t -135.59 -166.27 1.82 Allowed 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.731 1.151 . . . . 0.0 113.304 177.664 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -38.67 -65.12 0.38 Allowed 'General case' 0 N--CA 1.458 -0.064 0 C-N-CA 128.19 2.596 . . . . 0.0 113.175 -169.581 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 36.3 ttpt -51.96 -50.3 61.49 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 123.465 0.706 . . . . 0.0 110.238 -175.713 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -61.36 -43.97 97.97 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 123.25 0.62 . . . . 0.0 110.15 -177.616 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 34.7 mt -62.4 -50.89 69.73 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 118.187 0.449 . . . . 0.0 111.546 177.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -61.93 -42.3 98.94 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 -178.211 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -56.42 -65.33 0.62 Allowed 'General case' 0 C--O 1.22 -0.476 0 CA-C-O 118.515 -0.755 . . . . 0.0 109.13 169.51 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 5.5 mt -35.04 -62.98 0.35 Allowed 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 125.321 1.449 . . . . 0.0 111.687 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 15.9 tt -60.49 -50.78 79.0 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 C-N-CA 120.297 -0.561 . . . . 0.0 110.306 -175.074 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 16.0 tt0 -62.11 -41.07 97.86 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.317 0.508 . . . . 0.0 112.151 -176.301 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 6.2 mmpt? -69.85 -54.13 14.92 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.637 1.175 . . . . 0.0 109.473 -177.306 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 -83.43 -35.54 24.92 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.58 -0.736 . . . . 0.0 112.682 -167.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 47.1 mt . . . . . 0 C--N 1.339 0.14 0 CA-C-N 119.36 0.982 . . . . 0.0 108.809 170.834 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 . . . . . 0 CA--C 1.53 0.2 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.35 -58.15 0.15 Allowed 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 126.541 1.936 . . . . 0.0 113.972 -178.626 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 65.0 tt0 -68.34 -40.41 81.57 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 121.066 0.46 . . . . 0.0 110.878 -172.833 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 53' ' ' ILE . . . . . 0.64 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.9 mp -62.99 -52.5 58.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 N-CA-C 106.865 -1.531 . . . . 0.0 106.865 179.378 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 72.0 t -54.85 -46.63 75.49 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 C-N-CA 124.362 1.065 . . . . 0.0 109.829 178.615 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.42 -53.61 54.07 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 119.402 1.001 . . . . 0.0 110.565 175.404 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 39.9 mt -53.22 -41.47 65.38 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 118.972 -0.537 . . . . 0.0 111.494 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 27.8 mmt -70.21 -65.14 0.76 Allowed 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 118.716 0.689 . . . . 0.0 109.643 175.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -43.71 -35.02 1.67 Allowed 'General case' 0 CA--C 1.518 -0.282 0 C-N-CA 128.356 2.662 . . . . 0.0 112.192 -174.835 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -37.85 -49.97 1.24 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.0 0.92 . . . . 0.0 111.87 173.484 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.9 pp -61.34 -43.48 98.79 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.366 0.53 . . . . 0.0 111.331 -177.751 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -69.6 -41.11 76.19 Favored 'General case' 0 C--O 1.226 -0.183 0 C-N-CA 123.941 0.896 . . . . 0.0 110.113 -177.71 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 14.2 ttm180 -62.73 -48.5 78.96 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 124.76 1.224 . . . . 0.0 110.033 179.55 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 . . . . . 0 C--O 1.226 -0.143 0 CA-C-N 116.713 -0.221 . . . . 0.0 111.248 -175.401 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 16.3 mp0 . . . . . 0 N--CA 1.451 -0.413 0 CA-C-O 120.459 0.171 . . . . 0.0 110.839 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 25.2 m -101.56 151.22 5.65 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 N-CA-C 106.698 -1.593 . . . . 0.0 106.698 167.554 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 10.2 p30 -94.67 171.86 8.53 Favored 'General case' 0 C--O 1.231 0.129 0 C-N-CA 123.404 0.682 . . . . 0.0 110.624 176.516 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -35.5 -59.87 0.53 Allowed 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.351 1.461 . . . . 0.0 113.486 177.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -66.53 -31.77 72.71 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 120.429 1.468 . . . . 0.0 111.616 -174.383 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.34 -36.44 68.81 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 121.271 -0.893 . . . . 0.0 109.822 177.939 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -56.29 -53.77 53.29 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 168.4 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 19.9 mm -53.74 -42.0 49.96 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.406 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 177.806 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 70.4 m -63.06 -27.21 69.24 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 119.018 0.827 . . . . 0.0 111.831 177.802 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 10.7 t80 -58.35 -52.84 63.92 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.459 1.027 . . . . 0.0 108.321 170.131 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 48.8 mt -64.61 -41.31 96.29 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.861 0.865 . . . . 0.0 111.668 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -70.78 -42.27 61.77 Favored Glycine 0 CA--C 1.526 0.749 0 C-N-CA 124.408 1.004 . . . . 0.0 110.658 -175.871 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.21 -43.91 76.96 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 121.924 -0.75 . . . . 0.0 110.079 175.543 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 12.1 tp -49.61 -56.8 8.71 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 121.281 0.563 . . . . 0.0 109.774 171.159 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 81' ' ' ALA . . . . . 0.479 ' HB1' HD11 ' A' ' 13' ' ' ILE . . . -50.15 -53.67 25.99 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 124.391 1.076 . . . . 0.0 110.32 178.188 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 53.7 ttm -54.45 -50.07 68.55 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.937 0.895 . . . . 0.0 111.129 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 98.1 mt -63.95 -55.01 24.63 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 CA-C-O 118.48 -0.772 . . . . 0.0 110.578 -176.154 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.45 0.1 OUTLIER -76.69 -35.2 58.04 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.419 1.009 . . . . 0.0 113.284 -175.029 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 26.0 m-80 -82.55 72.79 9.61 Favored 'General case' 0 N--CA 1.465 0.284 0 O-C-N 120.63 -1.294 . . . . 0.0 107.97 169.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -46.89 -31.48 3.14 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.968 0.907 . . . . 0.0 113.051 -176.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -42.15 -41.88 2.81 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.879 1.272 . . . . 0.0 113.106 172.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 84.2 mt . . . . . 0 CA--C 1.531 0.226 0 C-N-CA 123.161 0.584 . . . . 0.0 112.424 -179.3 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.228 0 CA-C-O 120.868 0.366 . . . . 0.0 110.523 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.59 165.84 2.07 Favored Pre-proline 0 CA--C 1.538 0.493 0 C-N-CA 124.282 1.033 . . . . 0.0 111.143 176.922 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_exo -46.26 -47.98 13.99 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 123.367 2.711 . . . . 0.0 113.054 178.39 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.418 HD23 ' HA ' ' A' ' 5' ' ' LEU . 6.1 mt -56.95 -49.84 74.46 Favored 'General case' 0 C--N 1.34 0.168 0 CA-C-O 119.472 -0.299 . . . . 0.0 111.428 175.196 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -58.97 -45.04 91.52 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-N 118.248 0.476 . . . . 0.0 109.857 -178.352 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -59.43 -49.99 75.67 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 122.9 0.48 . . . . 0.0 110.239 178.55 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.69 -45.87 84.8 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.416 0.687 . . . . 0.0 111.666 -177.152 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 71.5 mt -54.72 -50.94 56.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 171.414 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.74 -49.44 22.09 Favored Glycine 0 CA--C 1.526 0.771 0 C-N-CA 125.012 1.291 . . . . 0.0 111.527 174.835 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.3 mt -54.79 -56.67 16.89 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 117.576 0.688 . . . . 0.0 110.889 173.921 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -57.28 -42.59 81.93 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 119.203 0.91 . . . . 0.0 111.72 -178.366 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 95.6 mt -59.81 -54.11 39.11 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 123.518 0.727 . . . . 0.0 110.908 174.542 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.4 -50.59 61.63 Favored Glycine 0 CA--C 1.522 0.511 0 N-CA-C 109.883 -1.287 . . . . 0.0 109.883 -177.731 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 9.9 mm -50.87 -51.76 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 C-N-CA 123.92 0.888 . . . . 0.0 109.968 173.672 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -52.24 -61.57 2.19 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 178.212 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 6.0 m-70 -65.33 -23.87 67.11 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 113.958 1.096 . . . . 0.0 113.958 -172.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 62.4 tttm -50.24 -31.94 15.35 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 118.766 0.712 . . . . 0.0 111.147 169.462 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -113.0 -33.54 6.01 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.482 0.713 . . . . 0.0 112.683 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 77.4 p . . . . . 0 N--CA 1.464 0.25 0 CA-C-N 119.891 1.223 . . . . 0.0 113.204 -178.803 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 46.0 p . . . . . 0 N--CA 1.456 -0.173 0 CA-C-O 120.849 0.357 . . . . 0.0 111.452 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -161.16 -177.19 5.9 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.377 1.471 . . . . 0.0 107.616 168.57 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.4 p -139.25 176.84 8.37 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 119.59 1.086 . . . . 0.0 112.805 -173.74 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 19.8 pttt -30.84 -53.78 0.19 Allowed 'General case' 0 N--CA 1.457 -0.099 0 C-N-CA 127.646 2.378 . . . . 0.0 114.874 179.057 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 24.8 ttpp -58.07 -49.12 78.03 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 118.888 0.767 . . . . 0.0 110.743 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.4 mp0 -64.07 -36.02 82.63 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 122.685 0.394 . . . . 0.0 110.619 178.345 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 45.2 mt -68.07 -47.6 67.85 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.617 0.644 . . . . 0.0 111.204 179.117 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -56.44 -47.38 79.22 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 173.63 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -53.81 -58.08 8.54 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-O 119.167 -0.445 . . . . 0.0 110.975 172.77 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.0 mt -45.52 -61.18 1.79 Allowed 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 124.291 1.036 . . . . 0.0 110.406 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 14.7 tt -61.06 -50.27 81.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 C-N-CA 120.507 -0.477 . . . . 0.0 109.858 -175.533 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -61.85 -53.18 59.39 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 121.493 -0.754 . . . . 0.0 112.305 -175.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -67.02 -59.03 3.82 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.988 0.915 . . . . 0.0 109.39 -178.315 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -79.78 -46.67 16.56 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 119.262 -0.399 . . . . 0.0 111.742 -168.142 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 20.1 mt . . . . . 0 C--O 1.232 0.145 0 CA-C-N 119.001 0.819 . . . . 0.0 109.41 174.166 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 . . . . . 0 C--O 1.225 -0.235 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -30.33 -56.47 0.19 Allowed 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 125.793 1.637 . . . . 0.0 113.382 176.346 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.9 tm-20 -64.89 -41.52 95.55 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.64 0.734 . . . . 0.0 110.384 -173.707 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.544 HD12 ' H ' ' A' ' 53' ' ' ILE . 1.1 mp -66.28 -52.74 44.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 N-CA-C 107.053 -1.462 . . . . 0.0 107.053 -177.784 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 78.6 t -52.89 -41.06 38.72 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 C-N-CA 124.64 1.176 . . . . 0.0 109.777 175.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.7 mptp? -60.53 -51.88 67.54 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 118.988 0.813 . . . . 0.0 110.851 174.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 85.6 mt -52.08 -43.0 63.65 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 119.316 -0.373 . . . . 0.0 110.872 177.036 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 24.7 mmt -68.75 -62.42 1.39 Allowed 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 118.475 0.579 . . . . 0.0 109.94 178.84 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -45.26 -40.61 7.71 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 127.093 2.157 . . . . 0.0 111.498 -177.13 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -40.94 -47.31 2.98 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.714 0.806 . . . . 0.0 112.462 175.029 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.1 mp -63.39 -53.86 45.87 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 -178.596 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -60.95 -34.11 74.23 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 123.625 0.77 . . . . 0.0 111.279 -178.06 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.9 ttm180 . . . . . 0 N--CA 1.449 -0.485 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 173.919 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 . . . . . 0 N--CA 1.454 -0.268 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 11.3 m -103.07 144.31 14.01 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 170.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -86.29 168.4 13.93 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 122.835 0.454 . . . . 0.0 111.158 174.25 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -34.4 -61.31 0.39 Allowed 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 124.547 1.139 . . . . 0.0 112.718 172.566 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 48.5 tp60 -63.22 -31.66 72.86 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 119.791 1.178 . . . . 0.0 112.072 -174.191 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -69.68 -42.43 74.14 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 121.305 -0.872 . . . . 0.0 110.022 176.489 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -54.92 -51.38 66.26 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 170.769 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 26.9 mm -56.25 -40.26 64.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 C-N-CA 123.158 0.583 . . . . 0.0 110.117 176.318 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 86.2 m -64.6 -39.01 92.96 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 118.926 0.784 . . . . 0.0 110.961 176.78 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 44.9 t80 -54.95 -53.54 54.29 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 172.27 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 58.7 mt -59.14 -42.18 90.03 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.962 -0.461 . . . . 0.0 111.83 176.98 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -62.41 -45.86 95.05 Favored Glycine 0 CA--C 1.525 0.709 0 C-N-CA 124.177 0.894 . . . . 0.0 110.959 -178.436 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.89 -44.68 84.6 Favored 'General case' 0 N--CA 1.45 -0.458 0 O-C-N 122.182 -0.599 . . . . 0.0 110.061 177.569 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 13.1 tp -51.18 -57.24 9.28 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.325 0.583 . . . . 0.0 109.899 173.538 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -48.75 -56.17 9.38 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 114.812 -1.085 . . . . 0.0 109.942 177.947 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 46.7 ttm -52.33 -54.44 31.55 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 123.916 0.886 . . . . 0.0 111.071 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 42.1 mt -63.49 -45.75 96.98 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 CA-C-O 118.302 -0.856 . . . . 0.0 110.856 -171.42 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.446 0.1 OUTLIER -83.05 -30.93 27.66 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 -179.844 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 24.3 m-80 -79.8 71.95 6.49 Favored 'General case' 0 C--O 1.236 0.355 0 O-C-N 120.926 -1.109 . . . . 0.0 108.433 170.348 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -65.0 74.18 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.572 1.549 . . . . 0.0 109.431 175.206 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -171.89 -47.38 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 128.684 2.794 . . . . 0.0 106.851 -169.792 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 55.7 mt . . . . . 0 C--N 1.343 0.306 0 N-CA-C 108.412 -0.958 . . . . 0.0 108.412 168.692 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.202 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -49.42 157.31 0.94 Allowed Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 125.459 1.504 . . . . 0.0 110.35 173.924 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -50.67 -48.42 20.65 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 122.911 2.407 . . . . 0.0 112.213 -174.45 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.7 mt -55.26 -52.82 62.17 Favored 'General case' 0 C--O 1.225 -0.231 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 172.146 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -58.68 -39.67 81.36 Favored 'General case' 0 C--O 1.225 -0.186 0 CA-C-N 118.243 0.474 . . . . 0.0 110.274 -175.76 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -64.33 -50.99 65.62 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.503 1.121 . . . . 0.0 110.483 177.715 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.53 -45.44 94.15 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 121.443 0.639 . . . . 0.0 111.128 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 67.1 mt -53.19 -53.97 20.11 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 169.922 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.6 -46.96 18.08 Favored Glycine 0 CA--C 1.526 0.775 0 C-N-CA 125.368 1.461 . . . . 0.0 111.986 176.249 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.7 mt -55.45 -56.07 24.4 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 117.635 0.717 . . . . 0.0 110.742 173.562 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.4 mp -57.59 -42.94 84.21 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 118.973 0.806 . . . . 0.0 111.6 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 77.8 mt -56.97 -55.55 19.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 C-N-CA 123.336 0.654 . . . . 0.0 110.173 174.096 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.24 -49.68 62.69 Favored Glycine 0 CA--C 1.522 0.527 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 -177.643 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.5 mm -52.36 -48.71 44.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 C-N-CA 123.242 0.617 . . . . 0.0 110.137 174.958 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -56.51 -58.2 9.05 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 118.491 0.587 . . . . 0.0 110.47 176.433 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -54.61 -36.96 65.03 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 125.002 1.321 . . . . 0.0 111.208 -174.594 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -49.7 -34.43 18.7 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.062 0.945 . . . . 0.0 111.957 177.215 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 -106.62 -47.67 3.71 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.325 0.65 . . . . 0.0 110.837 178.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 22.7 t . . . . . 0 CA--C 1.534 0.329 0 C-N-CA 123.839 0.856 . . . . 0.0 112.422 -177.866 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 45.6 t-80 . . . . . 0 C--O 1.236 0.349 0 CA-C-O 119.683 -0.199 . . . . 0.0 111.429 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 41.3 p -135.04 163.05 30.75 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.899 1.28 . . . . 0.0 110.459 -175.164 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -159.87 164.95 33.14 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.527 0.731 . . . . 0.0 110.988 169.634 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 93.6 p -97.97 168.0 10.56 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.462 1.105 . . . . 0.0 113.641 -169.027 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 13.6 pttm -40.04 -53.19 2.43 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 126.781 2.032 . . . . 0.0 112.617 171.526 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -54.65 -45.45 73.82 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.39 0.676 . . . . 0.0 109.968 178.771 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -71.36 -35.79 71.24 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 123.485 0.714 . . . . 0.0 111.073 -176.806 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 13.3 mt -62.91 -49.35 75.13 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.224 0.92 . . . . 0.0 110.896 170.924 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -58.03 -46.31 85.52 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 178.824 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -54.08 -57.17 12.09 Favored 'General case' 0 C--O 1.222 -0.344 0 CA-C-O 119.001 -0.524 . . . . 0.0 110.663 171.095 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 9.3 mt -45.44 -60.73 2.0 Favored 'General case' 0 N--CA 1.457 -0.09 0 C-N-CA 123.625 0.77 . . . . 0.0 110.48 -178.772 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 19.8 tt -60.1 -52.98 54.87 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 120.287 -0.565 . . . . 0.0 110.118 -177.307 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -59.47 -49.88 76.07 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.739 -0.601 . . . . 0.0 112.535 -174.528 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.11 -53.79 10.14 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.696 0.798 . . . . 0.0 109.815 -176.785 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 51.8 mm-40 -81.68 -26.62 34.55 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 -167.535 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 23.9 mt . . . . . 0 CA--C 1.523 -0.083 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 169.243 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 . . . . . 0 CA--C 1.53 0.191 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -35.7 -56.1 0.69 Allowed 'General case' 0 C--O 1.226 -0.14 0 C-N-CA 125.356 1.462 . . . . 0.0 113.148 -175.643 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -61.69 -41.83 98.11 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.444 0.697 . . . . 0.0 111.18 -176.127 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 53' ' ' ILE . . . . . 0.505 ' H ' ' CD1' ' B' ' 53' ' ' ILE . 1.1 mp -63.75 -54.08 36.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 106.852 -1.536 . . . . 0.0 106.852 -178.289 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 82.5 t -56.84 -41.13 75.22 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-N 115.265 -0.88 . . . . 0.0 109.729 179.157 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.44 -51.81 68.3 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 118.907 0.776 . . . . 0.0 110.073 177.507 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 44.9 mt -53.87 -41.11 67.16 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 119.361 -0.352 . . . . 0.0 111.404 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.05 -61.68 1.68 Allowed 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 118.642 0.656 . . . . 0.0 109.753 175.324 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -44.37 -36.4 2.82 Favored 'General case' 0 C--O 1.225 -0.205 0 C-N-CA 126.644 1.978 . . . . 0.0 111.949 -177.206 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -37.38 -46.88 0.81 Allowed 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 125.661 1.584 . . . . 0.0 112.717 178.48 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -59.27 -49.71 76.8 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 120.665 0.269 . . . . 0.0 110.394 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -64.42 -42.96 95.76 Favored 'General case' 0 C--O 1.225 -0.216 0 C-N-CA 124.089 0.956 . . . . 0.0 110.1 179.27 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.69 -45.33 70.33 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.697 1.599 . . . . 0.0 109.4 176.64 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 . . . . . 0 C--O 1.227 -0.091 0 C-N-CA 122.94 0.496 . . . . 0.0 112.136 178.563 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 . . . . . 0 N--CA 1.454 -0.257 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 14.5 m -86.57 150.78 3.74 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 171.837 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 5.2 p30 -91.35 172.78 8.29 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 123.293 0.637 . . . . 0.0 111.86 176.327 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -41.42 -62.13 0.92 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.258 1.023 . . . . 0.0 113.591 177.115 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 10.0 tp-100 -65.4 -31.35 72.41 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-N 120.094 1.316 . . . . 0.0 110.808 -177.085 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -64.14 -41.3 97.24 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.175 0.898 . . . . 0.0 110.569 175.692 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -57.78 -49.76 75.52 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 121.462 -0.774 . . . . 0.0 110.023 169.658 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 21.5 mm -60.07 -26.7 36.96 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 O-C-N 121.787 -0.571 . . . . 0.0 110.782 176.445 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 52.8 m -75.05 -37.5 61.67 Favored 'General case' 0 C--O 1.225 -0.225 0 O-C-N 120.95 -1.094 . . . . 0.0 110.345 173.072 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 29.1 t80 -55.29 -55.06 35.79 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 118.914 0.779 . . . . 0.0 109.235 170.667 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 43.9 mt -61.22 -47.3 86.76 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 122.085 -0.385 . . . . 0.0 111.694 177.844 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -62.1 -41.89 99.71 Favored Glycine 0 CA--C 1.526 0.735 0 N-CA-C 110.946 -0.862 . . . . 0.0 110.946 -175.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.18 -46.5 73.74 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 123.498 0.719 . . . . 0.0 110.268 175.8 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 18.1 tp -49.97 -53.55 25.73 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 174.36 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -53.48 -56.83 13.68 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 124.065 0.946 . . . . 0.0 110.394 175.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 40.3 ttm -47.94 -46.62 32.36 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.79 0.836 . . . . 0.0 111.052 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 30.8 mt -72.89 -51.92 24.85 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 CA-C-O 117.908 -1.044 . . . . 0.0 111.379 -176.149 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.416 0.0 OUTLIER -85.11 -36.46 21.13 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 120.31 1.414 . . . . 0.0 114.711 -175.198 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 32.8 m120 -81.87 62.44 5.66 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 107.259 -1.385 . . . . 0.0 107.259 171.036 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 67.2 mt-10 -44.97 -36.49 3.42 Favored 'General case' 0 C--N 1.339 0.111 0 C-N-CA 126.104 1.762 . . . . 0.0 113.618 -169.548 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -47.77 -31.93 5.41 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.384 1.074 . . . . 0.0 113.015 178.299 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 31.6 mt . . . . . 0 C--N 1.34 0.177 0 C-N-CA 122.761 0.424 . . . . 0.0 111.949 174.272 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.315 0 CA-C-O 120.666 0.269 . . . . 0.0 111.178 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.4 m -49.25 158.59 0.72 Allowed Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 124.202 1.001 . . . . 0.0 111.433 170.025 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -47.54 -48.28 15.89 Favored 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 123.354 2.703 . . . . 0.0 113.402 -177.446 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.0 mt -57.42 -49.24 76.87 Favored 'General case' 0 C--O 1.226 -0.183 0 C-N-CA 120.618 -0.433 . . . . 0.0 112.094 173.893 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -60.97 -41.57 96.63 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 -175.823 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 19.8 tt0 -59.77 -51.63 68.93 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.801 0.84 . . . . 0.0 110.677 175.214 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.35 -45.67 92.15 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.506 0.669 . . . . 0.0 111.271 -177.46 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 66.1 mt -53.28 -51.75 37.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 169.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.17 -48.2 20.35 Favored Glycine 0 CA--C 1.528 0.86 0 C-N-CA 125.183 1.373 . . . . 0.0 111.835 174.821 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.3 mt -55.12 -55.25 33.18 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 117.83 0.815 . . . . 0.0 110.795 174.067 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.0 mp -58.2 -41.71 84.6 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.55 0.614 . . . . 0.0 111.715 -179.373 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 97.1 mt -60.58 -51.33 74.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 C-N-CA 123.494 0.718 . . . . 0.0 110.733 174.509 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.99 -54.03 36.37 Favored Glycine 0 CA--C 1.521 0.462 0 N-CA-C 109.198 -1.561 . . . . 0.0 109.198 -179.02 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 7.2 mm -51.51 -50.77 28.3 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 C-N-CA 124.102 0.961 . . . . 0.0 110.375 175.145 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -50.63 -60.51 2.96 Favored 'General case' 0 C--N 1.339 0.121 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 177.73 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -59.33 -39.39 82.97 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 121.041 -0.263 . . . . 0.0 111.088 -175.622 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.7 ttpp -53.64 -24.77 15.23 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.096 0.958 . . . . 0.0 111.85 178.845 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -133.9 42.2 2.95 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 118.461 0.573 . . . . 0.0 110.774 169.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 63.6 p . . . . . 0 N--CA 1.457 -0.114 0 CA-C-O 122.254 1.026 . . . . 0.0 108.487 174.244 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 6.0 p . . . . . 0 CA--C 1.529 0.164 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.2 pp -160.25 -176.31 5.56 Favored 'General case' 0 C--N 1.337 0.024 0 C-N-CA 123.873 0.869 . . . . 0.0 109.533 176.37 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 87.4 p -152.7 -175.52 5.34 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 119.073 0.851 . . . . 0.0 111.955 -178.811 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -19.7 -69.56 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 129.381 3.072 . . . . 0.0 113.51 175.0 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -51.53 -50.63 59.64 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 124.874 1.269 . . . . 0.0 110.568 -177.394 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 14.1 mp0 -64.65 -42.77 95.21 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 119.157 -0.449 . . . . 0.0 109.87 -177.485 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 71.9 mt -60.99 -50.1 74.76 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.881 0.764 . . . . 0.0 111.21 177.517 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -59.56 -44.96 93.12 Favored 'General case' 0 CA--C 1.534 0.36 0 O-C-N 121.937 -0.477 . . . . 0.0 110.298 179.117 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 72.0 mt-10 -56.42 -52.36 64.93 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 122.57 0.348 . . . . 0.0 111.197 173.806 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 16.3 mt -49.51 -54.82 15.83 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.726 0.81 . . . . 0.0 109.471 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 40.7 mm -54.45 -65.87 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 175.366 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 -57.0 -49.24 76.39 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -169.398 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.7 -53.76 8.03 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.2 0.6 . . . . 0.0 110.426 -177.291 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -85.22 -16.59 39.73 Favored 'General case' 0 C--N 1.339 0.14 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -168.143 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 94.1 mt . . . . . 0 N--CA 1.458 -0.073 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 168.619 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 . . . . . 0 CA--C 1.532 0.259 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.88 -60.85 0.16 Allowed 'General case' 0 N--CA 1.46 0.038 0 C-N-CA 126.22 1.808 . . . . 0.0 113.3 -177.312 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -67.64 -38.71 84.25 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.836 -171.85 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.592 HD12 ' H ' ' A' ' 53' ' ' ILE . 1.6 mp -61.89 -53.38 48.86 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 N-CA-C 106.164 -1.791 . . . . 0.0 106.164 179.131 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 85.0 t -57.83 -44.46 86.26 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 C-N-CA 124.073 0.949 . . . . 0.0 110.552 -177.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.67 -50.61 73.23 Favored 'General case' 0 CA--C 1.528 0.116 0 CA-C-N 119.262 0.937 . . . . 0.0 111.202 173.263 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 63.2 mt -56.43 -38.22 71.29 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 119.115 -0.469 . . . . 0.0 111.446 178.52 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 23.3 mmt -69.38 -61.76 1.66 Allowed 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.117 0.871 . . . . 0.0 109.683 175.03 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -45.88 -40.47 10.04 Favored 'General case' 0 CA--C 1.52 -0.196 0 C-N-CA 126.96 2.104 . . . . 0.0 111.467 -175.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -38.29 -49.97 1.43 Allowed 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.964 1.305 . . . . 0.0 111.546 174.605 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 77.0 mt -56.69 -50.96 70.59 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 122.495 0.318 . . . . 0.0 110.186 -175.685 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -69.41 -44.9 70.46 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 123.268 0.627 . . . . 0.0 110.911 -179.099 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 16.9 ttm180 . . . . . 0 N--CA 1.454 -0.256 0 C-N-CA 124.128 0.971 . . . . 0.0 110.16 -179.065 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 . . . . . 0 N--CA 1.454 -0.247 0 CA-C-O 120.794 0.33 . . . . 0.0 110.987 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.7 m -117.57 160.24 17.24 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 C-N-CA 126.063 1.745 . . . . 0.0 107.955 168.751 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -105.98 -175.02 2.68 Favored 'General case' 0 CA--C 1.528 0.121 0 C-N-CA 125.102 1.361 . . . . 0.0 111.741 178.32 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -47.86 -66.14 0.45 Allowed 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 124.328 1.051 . . . . 0.0 112.001 176.069 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.1 tp60 -60.76 -35.56 76.73 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 119.565 1.075 . . . . 0.0 111.453 -173.251 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -61.61 -47.18 86.61 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.548 -0.72 . . . . 0.0 110.983 175.338 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -54.74 -50.6 67.99 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.993 -0.442 . . . . 0.0 109.954 172.549 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.405 ' CG2' ' CG2' ' B' ' 74' ' ' ILE . 25.3 mm -57.16 -37.45 55.89 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 C-N-CA 122.97 0.508 . . . . 0.0 110.331 177.533 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 86.6 m -68.09 -39.3 82.91 Favored 'General case' 0 N--CA 1.456 -0.143 0 O-C-N 121.513 -0.742 . . . . 0.0 110.315 177.49 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 38.0 t80 -56.57 -54.99 39.51 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 173.879 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 49.2 mt -59.92 -40.0 87.39 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 120.726 0.298 . . . . 0.0 111.476 176.067 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -60.08 -49.64 76.32 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 -179.093 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.9 -44.96 91.4 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 123.178 0.591 . . . . 0.0 110.25 178.341 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 11.0 tp -50.52 -57.91 7.0 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.636 0.731 . . . . 0.0 109.734 174.654 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.45 -53.58 43.66 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 125.037 1.335 . . . . 0.0 110.303 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 39.4 ttm -52.06 -50.06 62.25 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 125.542 1.537 . . . . 0.0 111.026 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 93.3 mt -69.0 -54.9 17.63 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 CA-C-O 118.698 -0.668 . . . . 0.0 110.294 -174.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.451 0.1 OUTLIER -76.14 -35.46 59.21 Favored 'General case' 0 C--N 1.344 0.351 0 C-N-CA 119.051 -1.06 . . . . 0.0 113.398 -173.599 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.4 m-80 -85.13 63.29 8.02 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 106.593 -1.632 . . . . 0.0 106.593 168.695 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -43.92 -36.77 2.55 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.541 1.136 . . . . 0.0 112.505 -175.729 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.38 -47.46 0.21 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 127.015 2.126 . . . . 0.0 113.165 169.507 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 20.3 mt . . . . . 0 C--O 1.225 -0.206 0 C-N-CA 123.974 0.91 . . . . 0.0 111.322 178.58 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.294 0 CA-C-O 121.412 0.625 . . . . 0.0 109.488 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -50.41 159.66 0.83 Allowed Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 124.999 1.319 . . . . 0.0 110.841 170.391 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -52.22 -49.35 17.68 Favored 'Trans proline' 0 N--CA 1.459 -0.538 0 C-N-CA 122.599 2.199 . . . . 0.0 112.1 -178.479 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.7 mt -58.09 -45.68 86.76 Favored 'General case' 0 C--O 1.226 -0.182 0 C-N-CA 120.624 -0.431 . . . . 0.0 111.03 174.75 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -58.07 -47.36 83.39 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 118.164 0.438 . . . . 0.0 109.835 -177.345 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 tp60 -60.61 -47.81 84.56 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 122.913 0.485 . . . . 0.0 110.896 177.259 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.66 -45.74 81.8 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.209 0.528 . . . . 0.0 111.46 -176.19 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 74.2 mt -54.14 -51.51 46.31 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 170.241 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.16 -47.46 20.85 Favored Glycine 0 CA--C 1.528 0.869 0 C-N-CA 124.797 1.189 . . . . 0.0 111.889 174.9 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 mt -56.26 -57.31 12.79 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 117.582 0.691 . . . . 0.0 110.635 174.122 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.6 mp -57.9 -41.18 82.08 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.047 0.84 . . . . 0.0 111.805 -177.754 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 74.0 mt -58.22 -56.41 16.27 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 C-N-CA 124.02 0.928 . . . . 0.0 110.741 172.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.64 -50.73 59.17 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 109.942 -1.263 . . . . 0.0 109.942 -176.801 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.8 mm -51.15 -50.58 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 C-N-CA 124.076 0.95 . . . . 0.0 110.107 173.514 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -54.05 -57.71 10.03 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 118.107 0.412 . . . . 0.0 110.222 179.088 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 41.9 m-70 -63.43 -29.23 70.55 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -176.56 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 64.5 tttp -50.45 -33.21 20.21 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 119.061 0.846 . . . . 0.0 111.841 176.096 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -108.62 -44.37 4.07 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.395 0.678 . . . . 0.0 111.083 177.456 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.2 m . . . . . 0 CA--C 1.53 0.208 0 C-N-CA 123.927 0.891 . . . . 0.0 112.751 -174.429 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 . . . . . 0 CA--C 1.535 0.369 0 CA-C-O 119.236 -0.411 . . . . 0.0 111.829 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 20.2 p -137.93 164.69 28.39 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.442 1.097 . . . . 0.0 111.304 -172.931 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.5 175.67 12.48 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.801 1.24 . . . . 0.0 109.184 169.507 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.2 t -131.39 -163.17 1.29 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.499 1.12 . . . . 0.0 112.55 -176.412 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 6.4 mtpm? -39.71 -67.51 0.22 Allowed 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 128.515 2.726 . . . . 0.0 113.461 -169.833 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -60.94 -46.85 89.03 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 -169.687 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -54.35 -44.67 72.35 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.48 0.712 . . . . 0.0 110.747 177.603 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 30.5 mt -65.06 -47.06 78.65 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 118.065 0.393 . . . . 0.0 111.599 178.543 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 58.5 mttp -57.08 -46.48 82.5 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.647 175.338 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -57.66 -49.36 76.74 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 122.955 0.502 . . . . 0.0 110.397 175.684 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 10.4 mt -48.16 -53.47 16.68 Favored 'General case' 0 CA--C 1.527 0.09 0 CA-C-N 119.15 0.886 . . . . 0.0 110.25 178.165 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 39.8 mt -57.84 -62.09 1.08 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.297 175.124 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -50.04 -46.87 53.44 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.484 0.714 . . . . 0.0 112.534 -172.802 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 9.1 mmpt? -81.43 -52.33 7.38 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 125.342 1.457 . . . . 0.0 110.451 -172.198 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -95.75 -16.83 21.68 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 -168.042 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 54.3 mt . . . . . 0 C--N 1.335 -0.033 0 C-N-CA 125.309 1.444 . . . . 0.0 108.154 173.712 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 18.0 p-10 . . . . . 0 N--CA 1.463 0.221 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.42 -61.33 0.14 Allowed 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 126.895 2.078 . . . . 0.0 113.831 -177.135 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -67.18 -38.71 85.86 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 120.804 0.335 . . . . 0.0 111.282 -172.814 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 53' ' ' ILE . . . . . 0.677 HD12 ' H ' ' B' ' 53' ' ' ILE . 2.1 mp -63.18 -53.89 40.31 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 N-CA-C 106.861 -1.533 . . . . 0.0 106.861 179.057 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 79.6 t -55.31 -45.35 77.79 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 C-N-CA 124.309 1.044 . . . . 0.0 110.134 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -58.17 -52.45 65.52 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 118.97 0.805 . . . . 0.0 110.203 176.364 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 62.9 mt -54.79 -39.5 68.51 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 119.43 -0.319 . . . . 0.0 111.418 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.83 -67.35 0.48 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 118.484 0.583 . . . . 0.0 109.524 173.727 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -39.62 -41.2 1.01 Allowed 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 127.364 2.266 . . . . 0.0 112.092 -176.862 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -37.88 -49.89 1.24 Allowed 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.162 1.385 . . . . 0.0 112.158 176.039 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -65.75 -33.7 76.47 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 111.699 0.259 . . . . 0.0 111.699 -174.261 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -76.8 -53.1 8.37 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 177.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 14.3 ttm180 -48.0 -41.57 25.7 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.311 1.044 . . . . 0.0 110.686 177.276 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 . . . . . 0 N--CA 1.454 -0.236 0 C-N-CA 123.911 0.884 . . . . 0.0 109.916 -178.298 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 64.8 mm-40 . . . . . 0 N--CA 1.452 -0.356 0 N-CA-C 106.042 -1.836 . . . . 0.0 106.042 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 12.3 m -79.25 142.28 14.22 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 176.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -82.41 170.31 15.44 Favored 'General case' 0 N--CA 1.461 0.108 0 C-N-CA 122.917 0.487 . . . . 0.0 111.578 177.395 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -35.37 -63.02 0.37 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.051 1.34 . . . . 0.0 112.82 173.177 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 10.1 tp-100 -64.53 -32.37 73.98 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 120.35 1.432 . . . . 0.0 111.817 -175.699 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -66.29 -39.38 89.32 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 120.966 -1.084 . . . . 0.0 110.274 176.06 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.03 -48.59 79.61 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 121.713 -0.617 . . . . 0.0 109.622 169.776 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 0.405 ' CG2' ' CG2' ' A' ' 74' ' ' ILE . 20.0 mm -62.18 -23.89 33.16 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 O-C-N 121.612 -0.68 . . . . 0.0 110.891 175.638 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 39.7 m -77.88 -33.72 51.89 Favored 'General case' 0 C--O 1.224 -0.273 0 O-C-N 120.762 -1.211 . . . . 0.0 110.426 171.765 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -60.16 -55.77 29.72 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.298 -0.876 . . . . 0.0 108.977 170.93 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 45.4 mt -62.8 -41.62 99.36 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-O 121.035 0.445 . . . . 0.0 111.773 177.186 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.9 -43.27 96.27 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.598 -1.001 . . . . 0.0 110.598 -178.231 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.55 -46.29 86.64 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.349 0.66 . . . . 0.0 110.209 174.795 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 6.8 tp -50.41 -58.14 6.39 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.403 0.621 . . . . 0.0 109.83 174.426 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.5 -52.81 35.1 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.86 1.264 . . . . 0.0 110.21 178.305 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 57.1 ttm -57.14 -47.43 81.17 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 124.19 0.996 . . . . 0.0 111.139 -178.166 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 97.1 mt -65.42 -58.63 6.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 -176.765 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.448 1.1 p90 -67.09 -40.58 86.99 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 118.218 -1.393 . . . . 0.0 112.501 -174.489 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 28.3 m-80 -81.71 66.98 7.51 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 169.409 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -44.0 -35.44 2.07 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.842 1.257 . . . . 0.0 113.815 -171.338 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -32.84 -53.3 0.34 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.537 1.535 . . . . 0.0 112.246 168.787 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 69.1 mt . . . . . 0 CA--C 1.534 0.351 0 N-CA-C 113.787 1.032 . . . . 0.0 113.787 -171.648 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.292 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 40.0 p -73.68 170.58 13.68 Favored Pre-proline 0 N--CA 1.451 -0.38 0 C-N-CA 123.206 0.602 . . . . 0.0 110.059 175.299 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -50.58 -43.93 42.77 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.299 1.999 . . . . 0.0 110.658 168.508 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.448 HD23 ' HA ' ' A' ' 5' ' ' LEU . 4.8 mt -53.38 -61.06 2.54 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-O 119.234 -0.412 . . . . 0.0 111.531 170.204 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -56.9 -39.22 74.01 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 118.495 0.589 . . . . 0.0 111.172 -174.237 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 -61.19 -51.04 70.67 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.782 0.833 . . . . 0.0 110.686 175.504 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.22 -44.9 95.52 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.454 0.702 . . . . 0.0 111.323 -178.682 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 95.4 mt -54.87 -52.26 44.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 171.08 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.3 -47.43 21.71 Favored Glycine 0 CA--C 1.526 0.759 0 C-N-CA 125.309 1.433 . . . . 0.0 111.929 175.003 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 mt -55.14 -54.74 39.38 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 117.739 0.77 . . . . 0.0 110.43 174.022 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.6 mp -58.84 -44.17 90.89 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 119.344 0.975 . . . . 0.0 111.756 -179.325 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 88.5 mt -55.94 -56.53 12.24 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 C-N-CA 123.398 0.679 . . . . 0.0 110.304 174.476 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.19 -50.08 64.15 Favored Glycine 0 CA--C 1.522 0.471 0 N-CA-C 110.046 -1.221 . . . . 0.0 110.046 -176.529 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 8.8 mm -52.94 -47.86 52.54 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 C-N-CA 123.465 0.706 . . . . 0.0 110.139 175.282 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -55.25 -65.15 0.64 Allowed 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 118.432 0.56 . . . . 0.0 109.74 177.456 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 25.5 m-70 -61.92 -26.79 68.39 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 118.41 -0.805 . . . . 0.0 113.018 -172.855 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 65.1 tttp -49.21 -35.99 18.78 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 119.366 0.984 . . . . 0.0 111.107 171.841 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 71.7 m-85 -103.6 -56.34 2.23 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 122.994 0.518 . . . . 0.0 110.084 177.021 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 C--O 1.225 -0.231 0 C-N-CA 122.988 0.515 . . . . 0.0 111.924 -176.257 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.449 -0.509 0 CA-C-O 120.916 0.389 . . . . 0.0 110.374 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.56 173.5 15.42 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.099 0.96 . . . . 0.0 109.171 173.057 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 54.5 p -117.94 171.97 7.72 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 123.596 0.759 . . . . 0.0 112.28 -172.585 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.7 pttm -31.74 -49.17 0.16 Allowed 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 127.197 2.199 . . . . 0.0 113.416 169.28 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.5 -54.83 42.55 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.411 0.624 . . . . 0.0 109.533 -177.109 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.2 mp0 -60.62 -41.91 95.8 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.339 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 69.6 mt -59.16 -48.77 80.37 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 118.447 0.567 . . . . 0.0 111.405 178.519 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -62.6 -31.57 72.43 Favored 'General case' 0 N--CA 1.457 -0.122 0 C-N-CA 123.397 0.679 . . . . 0.0 110.881 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.43 -68.83 0.34 Allowed 'General case' 0 C--O 1.22 -0.463 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 167.052 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.3 mt -30.13 -65.65 0.11 Allowed 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 126.075 1.75 . . . . 0.0 113.266 -177.452 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 20.0 tt -59.34 -51.94 66.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.231 -175.105 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -57.84 -45.76 85.74 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 125.208 1.403 . . . . 0.0 111.91 -177.889 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.0 mmpt? -72.21 -48.89 39.6 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 124.982 1.313 . . . . 0.0 110.263 -175.226 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -92.58 -52.77 4.48 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.306 0.642 . . . . 0.0 111.052 -169.201 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 31.9 mt . . . . . 0 C--N 1.335 -0.05 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 172.793 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 . . . . . 0 CA--C 1.533 0.299 0 N-CA-C 112.473 0.545 . . . . 0.0 112.473 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.31 -59.99 0.14 Allowed 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 126.984 2.114 . . . . 0.0 114.421 -176.783 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -63.63 -43.33 97.13 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 121.119 0.485 . . . . 0.0 110.332 -173.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.644 HD12 ' H ' ' A' ' 53' ' ' ILE . 2.5 mp -63.1 -51.2 74.58 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 107.264 -1.384 . . . . 0.0 107.264 -178.75 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 72.7 t -55.11 -49.32 72.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 C-N-CA 123.554 0.742 . . . . 0.0 109.867 178.218 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -53.79 -53.07 57.5 Favored 'General case' 0 CA--C 1.527 0.092 0 CA-C-N 118.826 0.739 . . . . 0.0 110.595 176.338 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.4 mt -51.14 -43.0 61.12 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 119.34 -0.362 . . . . 0.0 111.737 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.48 -68.07 0.48 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 118.411 0.55 . . . . 0.0 109.85 175.38 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -43.86 -35.12 1.83 Allowed 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 128.037 2.535 . . . . 0.0 112.689 -174.34 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -38.39 -48.68 1.38 Allowed 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 124.738 1.215 . . . . 0.0 112.585 171.306 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -65.21 -36.7 84.99 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 117.877 0.308 . . . . 0.0 111.349 -176.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -71.04 -43.99 66.71 Favored 'General case' 0 C--O 1.226 -0.135 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 179.282 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 22.5 ttm105 . . . . . 0 CA--C 1.53 0.188 0 C-N-CA 123.195 0.598 . . . . 0.0 110.18 175.918 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 . . . . . 0 CA--C 1.531 0.226 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.6 m -119.13 149.21 21.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 169.083 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.8 p30 -93.2 169.15 10.61 Favored 'General case' 0 C--O 1.232 0.169 0 C-N-CA 123.677 0.791 . . . . 0.0 110.096 172.115 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -34.63 -59.0 0.48 Allowed 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 124.95 1.3 . . . . 0.0 113.261 176.041 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 34.6 tp60 -68.2 -29.25 68.05 Favored 'General case' 0 CA--C 1.528 0.116 0 O-C-N 120.848 -1.158 . . . . 0.0 111.464 -173.078 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.2 -31.7 66.12 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.408 -0.808 . . . . 0.0 110.063 174.085 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -61.16 -47.26 87.02 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.365 -0.834 . . . . 0.0 109.254 167.563 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 26.5 mm -59.96 -29.48 43.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 O-C-N 121.784 -0.572 . . . . 0.0 110.586 174.759 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 28.6 m -72.38 -39.15 68.25 Favored 'General case' 0 C--O 1.225 -0.195 0 O-C-N 121.26 -0.9 . . . . 0.0 111.225 172.269 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 48.1 t80 -58.83 -54.71 43.98 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 118.88 0.764 . . . . 0.0 109.454 174.414 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 29.2 mt -59.46 -44.97 92.88 Favored 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 122.477 0.311 . . . . 0.0 111.068 175.174 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -60.4 -39.86 96.79 Favored Glycine 0 CA--C 1.524 0.651 0 C-N-CA 123.727 0.679 . . . . 0.0 111.464 -178.122 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.99 -49.64 56.05 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.819 0.848 . . . . 0.0 110.057 176.61 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -47.38 -53.8 12.9 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.607 0.763 . . . . 0.0 109.731 173.632 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -54.62 -60.65 3.07 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 124.669 1.187 . . . . 0.0 110.6 176.199 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 53.9 ttm -48.93 -45.28 41.4 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 124.037 0.935 . . . . 0.0 111.333 -178.568 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 57.4 mt -65.82 -60.09 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-O 118.482 -0.77 . . . . 0.0 109.901 -178.05 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.379 0.0 OUTLIER -76.64 -31.61 57.48 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 113.96 1.096 . . . . 0.0 113.96 -172.67 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.7 m120 -82.39 58.02 3.92 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 169.801 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -39.53 -40.44 0.86 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 127.251 2.22 . . . . 0.0 115.046 -168.285 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -45.9 -38.41 7.45 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.914 1.286 . . . . 0.0 112.375 178.581 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 93.0 mt . . . . . 0 CA--C 1.533 0.318 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 179.983 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.319 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.5 m -47.58 156.68 0.63 Allowed Pre-proline 0 CA--C 1.534 0.343 0 C-N-CA 126.245 1.818 . . . . 0.0 112.323 -179.38 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -41.65 -49.75 5.15 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 123.947 3.098 . . . . 0.0 114.25 -177.821 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 4.5 mt -56.19 -51.08 69.34 Favored 'General case' 0 N--CA 1.457 -0.111 0 N-CA-C 113.175 0.806 . . . . 0.0 113.175 172.517 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -61.68 -36.68 81.58 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 118.353 0.524 . . . . 0.0 109.85 -178.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -59.97 -53.8 53.57 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 124.396 1.078 . . . . 0.0 109.551 175.617 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.05 -47.41 86.53 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.102 0.961 . . . . 0.0 111.148 -178.214 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 72.0 mt -52.84 -53.0 23.37 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 170.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -49.29 -44.57 35.08 Favored Glycine 0 CA--C 1.525 0.676 0 C-N-CA 125.45 1.5 . . . . 0.0 111.882 176.864 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.1 mt -59.32 -54.45 46.67 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.651 0.78 . . . . 0.0 110.89 174.54 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 mp -58.49 -43.36 88.97 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 118.911 0.778 . . . . 0.0 111.43 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 85.4 mt -57.73 -52.65 55.04 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.207 0 C-N-CA 123.739 0.816 . . . . 0.0 110.611 173.012 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.25 -50.18 60.63 Favored Glycine 0 CA--C 1.523 0.551 0 N-CA-C 109.788 -1.325 . . . . 0.0 109.788 -177.313 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.9 mm -54.2 -50.81 53.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 C-N-CA 123.391 0.676 . . . . 0.0 110.387 175.216 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 16' ' ' PHE . . . . . 0.413 ' HB2' ' CE2' ' B' ' 73' ' ' TYR . 39.7 t80 -53.43 -56.59 15.58 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 121.699 0.762 . . . . 0.0 110.862 177.75 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 44.1 t60 -63.85 -37.4 87.25 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 124.573 1.149 . . . . 0.0 110.696 -171.587 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -49.67 -49.3 47.98 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.913 0.885 . . . . 0.0 110.91 175.006 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -88.42 -33.39 17.9 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 122.277 -0.264 . . . . 0.0 111.121 -174.846 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 14.6 m . . . . . 0 CA--C 1.536 0.414 0 CA-C-N 118.346 0.521 . . . . 0.0 110.721 175.564 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 18.0 m80 . . . . . 0 CA--C 1.538 0.517 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 59.3 p -139.57 158.61 43.83 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.725 1.61 . . . . 0.0 107.624 172.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -161.4 179.01 8.61 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.057 171.457 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.3 t -135.68 -165.74 1.74 Allowed 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.659 1.118 . . . . 0.0 112.441 -176.919 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 24.1 pttm -47.14 -52.05 16.52 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 126.575 1.95 . . . . 0.0 112.618 -170.468 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 18.8 tptp -52.1 -51.31 58.55 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 124.247 1.019 . . . . 0.0 110.825 178.79 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 27.9 mp0 -69.21 -36.5 77.31 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.282 -176.425 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 19.2 mt -66.03 -47.67 73.62 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 118.842 0.746 . . . . 0.0 111.429 176.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -57.69 -48.72 78.76 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 175.241 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 58.2 mt-10 -53.04 -58.34 7.32 Favored 'General case' 0 C--O 1.222 -0.384 0 CA-C-O 119.363 -0.351 . . . . 0.0 110.914 172.842 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 10.2 mt -44.46 -62.56 1.14 Allowed 'General case' 0 CA--C 1.521 -0.165 0 C-N-CA 124.521 1.128 . . . . 0.0 110.229 179.75 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 15.3 tt -63.35 -47.01 93.96 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 C-N-CA 120.064 -0.654 . . . . 0.0 110.449 -174.9 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 16.0 tt0 -60.13 -49.34 78.02 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.409 -0.807 . . . . 0.0 111.717 -177.411 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -73.85 -52.15 13.94 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.838 0.855 . . . . 0.0 109.766 -175.907 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -85.15 -18.75 33.19 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -169.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 15.6 mt . . . . . 0 CA--C 1.53 0.192 0 C-N-CA 124.605 1.162 . . . . 0.0 108.364 175.214 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 . . . . . 0 CA--C 1.53 0.187 0 CA-C-O 120.537 0.208 . . . . 0.0 110.556 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -37.69 -56.47 1.06 Allowed 'General case' 0 C--O 1.225 -0.209 0 C-N-CA 125.383 1.473 . . . . 0.0 113.874 -171.002 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -61.21 -40.36 93.67 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.275 0.56 . . . . 0.0 110.88 -175.257 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 53' ' ' ILE . . . . . 0.672 HD12 ' H ' ' B' ' 53' ' ' ILE . 2.4 mp -68.44 -49.85 62.1 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 N-CA-C 106.873 -1.528 . . . . 0.0 106.873 -177.144 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 92.9 t -53.83 -45.06 62.12 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.263 0 C-N-CA 123.239 0.616 . . . . 0.0 110.141 175.655 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -57.17 -52.74 64.09 Favored 'General case' 0 CA--C 1.527 0.075 0 CA-C-N 118.715 0.689 . . . . 0.0 110.235 175.512 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 30.9 mt -52.51 -41.36 63.37 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 119.038 -0.505 . . . . 0.0 111.419 178.375 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 27.6 mmt -68.94 -61.9 1.61 Allowed 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.926 0.785 . . . . 0.0 109.914 176.329 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -44.11 -36.38 2.57 Favored 'General case' 0 CA--C 1.522 -0.131 0 C-N-CA 127.724 2.41 . . . . 0.0 111.899 -177.918 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -38.86 -49.42 1.65 Allowed 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 124.542 1.137 . . . . 0.0 112.061 175.738 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -57.87 -53.77 54.49 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.342 0.519 . . . . 0.0 109.909 -178.381 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -60.95 -39.63 90.25 Favored 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 124.352 1.061 . . . . 0.0 111.011 -178.57 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 36.0 ttm-85 -62.36 -54.94 33.06 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.473 0.709 . . . . 0.0 109.902 178.738 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 . . . . . 0 CA--C 1.52 -0.206 0 CA-C-O 119.642 -0.218 . . . . 0.0 111.138 -173.4 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 10.7 mp0 . . . . . 0 N--CA 1.453 -0.279 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 33.7 m -79.58 155.17 4.67 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 172.464 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 3.5 p30 -101.07 171.96 7.31 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.638 0.733 . . . . 0.0 110.527 171.359 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -31.8 -58.35 0.28 Allowed 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 126.627 1.971 . . . . 0.0 113.65 178.061 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 44.3 tp60 -65.9 -39.14 90.34 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.943 1.247 . . . . 0.0 112.201 -169.253 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -69.37 -38.78 78.22 Favored 'General case' 0 C--O 1.234 0.248 0 O-C-N 121.57 -0.706 . . . . 0.0 109.732 177.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 73' ' ' TYR . . . . . 0.413 ' CE2' ' HB2' ' B' ' 16' ' ' PHE . 1.0 OUTLIER -54.96 -55.47 30.37 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 171.77 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 19.3 mm -50.59 -48.34 26.89 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.26 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 178.336 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 34.2 m -59.88 -20.87 59.7 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -179.424 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 15.3 t80 -61.25 -49.31 77.62 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 119.48 1.036 . . . . 0.0 108.398 169.312 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 44.2 mt -71.3 -39.48 71.43 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.164 0.986 . . . . 0.0 110.936 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -58.31 -50.03 70.47 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.025 -1.23 . . . . 0.0 110.025 176.041 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.2 -45.68 93.58 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 122.817 0.447 . . . . 0.0 110.638 175.406 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 14.8 tp -51.46 -56.07 15.35 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.087 0.47 . . . . 0.0 110.075 177.57 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.42 -58.78 5.31 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 124.323 1.049 . . . . 0.0 109.896 175.917 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 55.6 ttm -50.63 -44.97 57.51 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.93 0.892 . . . . 0.0 111.315 -176.833 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 98.6 mt -70.19 -62.3 1.34 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 118.322 -0.846 . . . . 0.0 110.822 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.427 0.1 OUTLIER -71.38 -38.97 71.47 Favored 'General case' 0 C--N 1.347 0.476 0 C-N-CA 118.691 -1.204 . . . . 0.0 112.676 -170.919 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -85.98 62.54 7.51 Favored 'General case' 0 C--N 1.335 -0.048 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 168.43 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -42.72 -36.84 1.56 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.709 1.604 . . . . 0.0 112.573 -176.233 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -31.87 -49.68 0.18 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 126.804 2.042 . . . . 0.0 112.7 169.506 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 17.3 mt . . . . . 0 C--O 1.226 -0.183 0 C-N-CA 124.561 1.144 . . . . 0.0 112.608 -179.592 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.214 0 CA-C-O 121.866 0.841 . . . . 0.0 110.202 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 14.9 m -64.5 164.5 19.38 Favored Pre-proline 0 CA--C 1.539 0.557 0 C-N-CA 125.137 1.375 . . . . 0.0 110.013 -176.758 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_exo -47.61 -47.95 16.87 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 123.171 2.58 . . . . 0.0 113.042 -178.837 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.419 HD23 ' HA ' ' A' ' 5' ' ' LEU . 5.2 mt -56.4 -47.49 78.89 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-O 119.195 -0.431 . . . . 0.0 112.036 173.201 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -61.66 -41.34 97.41 Favored 'General case' 0 C--O 1.227 -0.11 0 CA-C-N 118.717 0.689 . . . . 0.0 109.649 -176.858 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.5 tt0 -62.03 -49.78 74.64 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 122.855 0.462 . . . . 0.0 110.826 175.969 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.8 -46.34 89.97 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.534 0.683 . . . . 0.0 111.423 -178.769 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 68.8 mt -53.7 -52.31 35.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.196 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 170.385 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.87 -47.35 19.25 Favored Glycine 0 CA--C 1.526 0.769 0 C-N-CA 125.204 1.383 . . . . 0.0 111.88 175.478 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 mt -55.69 -54.86 39.13 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 117.706 0.753 . . . . 0.0 110.958 173.819 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.11 -44.35 87.65 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 118.809 0.731 . . . . 0.0 111.742 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.425 HD11 ' HB1' ' B' ' 81' ' ' ALA . 83.1 mt -56.81 -53.8 37.59 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 C-N-CA 123.422 0.689 . . . . 0.0 110.003 174.467 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -53.88 -50.22 55.45 Favored Glycine 0 CA--C 1.523 0.538 0 N-CA-C 110.111 -1.196 . . . . 0.0 110.111 -178.838 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 7.3 mm -55.33 -46.48 78.29 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 123.269 0.628 . . . . 0.0 110.513 176.028 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -56.23 -57.88 10.31 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 118.738 0.699 . . . . 0.0 110.233 175.911 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -56.41 -37.14 69.76 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 124.158 0.983 . . . . 0.0 111.234 -175.352 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -51.04 -32.16 20.77 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.801 1.24 . . . . 0.0 111.903 178.271 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -108.61 -53.44 2.64 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.108 0.563 . . . . 0.0 110.233 177.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 23.1 t . . . . . 0 CA--C 1.53 0.208 0 C-N-CA 123.458 0.703 . . . . 0.0 110.921 -179.267 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 41.6 p . . . . . 0 N--CA 1.451 -0.382 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -161.36 170.8 19.42 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.548 1.139 . . . . 0.0 108.212 169.144 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 59.9 p -127.22 173.97 9.31 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 119.343 0.974 . . . . 0.0 112.482 -169.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.4 ptmm? -26.48 -55.9 0.08 Allowed 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 128.339 2.656 . . . . 0.0 114.565 175.074 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -55.63 -55.65 29.58 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 123.457 0.703 . . . . 0.0 110.233 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 7.7 mp0 -62.59 -35.64 80.16 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-O 118.949 -0.548 . . . . 0.0 110.49 -179.212 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 51.7 mt -66.69 -50.22 63.58 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 118.755 0.707 . . . . 0.0 111.217 178.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -59.77 -43.73 94.22 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 110.094 -0.335 . . . . 0.0 110.094 177.159 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -55.9 -64.83 0.73 Allowed 'General case' 0 C--O 1.219 -0.508 0 CA-C-O 118.467 -0.778 . . . . 0.0 109.646 170.834 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.3 mt -35.56 -62.16 0.42 Allowed 'General case' 0 N--CA 1.461 0.112 0 C-N-CA 125.42 1.488 . . . . 0.0 111.499 179.26 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 9.2 tt -60.81 -51.58 71.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 120.292 -0.563 . . . . 0.0 109.866 -174.859 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -60.61 -42.4 96.76 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.588 -0.695 . . . . 0.0 112.443 -177.106 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -72.67 -55.04 7.42 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.93 1.292 . . . . 0.0 109.534 -175.212 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -85.97 -24.97 26.3 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.735 0.814 . . . . 0.0 113.005 -168.081 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 67.9 mt . . . . . 0 C--N 1.338 0.099 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 168.441 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.0 p30 . . . . . 0 N--CA 1.462 0.125 0 CA-C-O 119.237 -0.411 . . . . 0.0 111.283 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -34.16 -57.98 0.47 Allowed 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 125.181 1.392 . . . . 0.0 113.81 -173.396 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 77.1 tt0 -66.04 -40.94 91.42 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.975 0.51 . . . . 0.0 111.486 -174.092 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.603 HD12 ' H ' ' A' ' 53' ' ' ILE . 2.2 mp -63.05 -52.69 56.0 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.46 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 -179.775 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 77.6 t -54.36 -48.27 68.42 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 C-N-CA 123.975 0.91 . . . . 0.0 109.877 177.86 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -53.56 -52.94 58.1 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 118.871 0.759 . . . . 0.0 111.112 177.091 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 30.9 mt -52.59 -42.88 64.92 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 119.378 -0.344 . . . . 0.0 111.462 -179.619 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.52 -63.54 1.1 Allowed 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 118.457 0.571 . . . . 0.0 109.873 176.687 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -38.93 -46.35 1.3 Allowed 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 127.327 2.251 . . . . 0.0 111.818 -177.74 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -38.91 -48.81 1.62 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.701 1.2 . . . . 0.0 112.6 177.064 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.1 mp -57.39 -51.56 68.91 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 -177.186 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -65.94 -40.99 91.87 Favored 'General case' 0 C--O 1.225 -0.231 0 C-N-CA 122.654 0.382 . . . . 0.0 110.764 179.653 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 12.7 ttp180 . . . . . 0 N--CA 1.453 -0.284 0 C-N-CA 122.842 0.457 . . . . 0.0 110.568 -178.072 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 21.1 mp0 . . . . . 0 N--CA 1.45 -0.473 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.7 m -83.19 150.71 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 176.236 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -89.64 177.07 6.63 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 123.267 0.627 . . . . 0.0 110.693 175.058 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -44.43 -60.86 1.75 Allowed 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.84 0.856 . . . . 0.0 111.861 174.19 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.0 tp60 -62.49 -35.81 80.53 Favored 'General case' 0 C--O 1.225 -0.19 0 CA-C-N 119.376 0.989 . . . . 0.0 111.822 -173.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -65.51 -40.53 93.12 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 119.519 1.054 . . . . 0.0 111.277 174.944 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -55.62 -51.77 66.07 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.801 -0.562 . . . . 0.0 109.525 170.345 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 29.0 mm -56.53 -39.91 65.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 O-C-N 122.029 -0.419 . . . . 0.0 110.335 177.216 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 84.8 m -64.19 -39.59 94.31 Favored 'General case' 0 C--O 1.226 -0.151 0 O-C-N 121.614 -0.679 . . . . 0.0 110.384 178.715 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -55.27 -53.33 57.45 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 173.418 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 61.7 mt -60.32 -42.35 95.42 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.673 -0.24 . . . . 0.0 111.572 177.909 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -62.31 -46.9 92.93 Favored Glycine 0 CA--C 1.526 0.768 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 -179.083 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.6 -48.83 77.72 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 122.173 -0.604 . . . . 0.0 109.758 177.248 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 16.7 tp -50.37 -57.96 6.78 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.72 0.772 . . . . 0.0 110.029 176.052 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.447 ' HB1' HD11 ' B' ' 13' ' ' ILE . . . -48.42 -54.88 12.46 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 125.109 1.364 . . . . 0.0 109.955 177.772 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 9.1 ttp -59.99 -48.31 82.24 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 123.342 0.657 . . . . 0.0 111.655 -176.802 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.404 HD13 HG21 ' A' ' 83' ' ' ILE . 93.7 mt -59.55 -54.28 36.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 CA-C-O 118.135 -0.936 . . . . 0.0 110.128 -179.033 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.439 1.3 p90 -76.41 -38.72 55.18 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 120.097 1.317 . . . . 0.0 113.309 -175.742 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 27.8 m-80 -79.88 74.19 6.62 Favored 'General case' 0 N--CA 1.463 0.206 0 O-C-N 121.008 -1.058 . . . . 0.0 108.552 173.169 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -36.33 -43.19 0.36 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.309 1.444 . . . . 0.0 113.512 176.695 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -39.97 -41.96 1.29 Allowed 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.11 1.764 . . . . 0.0 113.54 174.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 47.6 mt . . . . . 0 CA--C 1.528 0.129 0 CA-C-O 118.864 -0.589 . . . . 0.0 112.349 -178.505 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.265 0 CA-C-O 120.81 0.338 . . . . 0.0 111.005 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.1 m -54.89 163.23 1.53 Allowed Pre-proline 0 CA--C 1.54 0.587 0 C-N-CA 124.686 1.194 . . . . 0.0 111.698 175.65 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -46.89 -50.33 10.99 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 123.597 2.864 . . . . 0.0 113.185 179.685 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.2 mt -54.73 -48.6 72.34 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-O 119.476 -0.297 . . . . 0.0 111.535 173.893 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -61.4 -42.38 98.63 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 118.315 0.507 . . . . 0.0 109.973 -176.036 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.2 tp60 -63.64 -47.22 82.23 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 122.367 0.267 . . . . 0.0 110.922 176.791 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.5 -47.19 82.75 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 121.339 0.59 . . . . 0.0 110.869 -178.012 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 69.5 mt -52.68 -55.34 11.76 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.248 0 N-CA-C 108.075 -1.084 . . . . 0.0 108.075 169.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -45.77 -45.97 13.41 Favored Glycine 0 CA--C 1.526 0.772 0 C-N-CA 125.352 1.453 . . . . 0.0 112.079 177.033 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.2 mt -55.72 -55.92 26.6 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.493 0.717 . . . . 0.0 110.782 173.371 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.9 mp -58.51 -43.03 88.97 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 118.898 0.772 . . . . 0.0 111.863 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 13' ' ' ILE . . . . . 0.447 HD11 ' HB1' ' A' ' 81' ' ' ALA . 52.1 mt -57.48 -57.76 8.88 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 C-N-CA 123.435 0.694 . . . . 0.0 109.938 174.961 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.06 -48.84 61.53 Favored Glycine 0 CA--C 1.521 0.421 0 N-CA-C 109.968 -1.253 . . . . 0.0 109.968 -177.164 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 5.8 mm -54.22 -46.88 68.32 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 C-N-CA 123.515 0.726 . . . . 0.0 110.878 175.274 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -56.62 -61.42 2.44 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 118.719 0.69 . . . . 0.0 109.32 175.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -55.02 -37.33 66.51 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.727 0.811 . . . . 0.0 111.771 -173.51 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -45.68 -38.95 7.35 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.289 1.435 . . . . 0.0 111.197 175.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -101.56 -60.15 1.58 Allowed 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 176.013 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.5 m . . . . . 0 C--N 1.338 0.091 0 C-N-CA 123.845 0.858 . . . . 0.0 112.617 -173.061 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 11.9 t-80 . . . . . 0 CA--C 1.535 0.399 0 CA-C-O 120.217 0.056 . . . . 0.0 110.994 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 1.1 p -129.65 160.99 31.62 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 125.374 1.469 . . . . 0.0 110.715 -173.45 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -156.51 161.37 40.02 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.081 0.552 . . . . 0.0 111.449 169.496 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 75.5 m -108.2 158.76 17.16 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.649 1.18 . . . . 0.0 113.145 -174.84 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 14.5 ptpt -22.64 -58.35 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 129.048 2.939 . . . . 0.0 115.397 179.456 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 18.2 tppt? -46.52 -50.04 17.72 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.24 1.016 . . . . 0.0 111.094 179.222 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 80.1 mt-10 -69.67 -27.94 65.45 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 119.037 -0.506 . . . . 0.0 111.847 -178.273 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 19.7 mt -73.9 -46.37 44.92 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 119.153 0.888 . . . . 0.0 110.049 176.756 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 39.0 mttp -56.16 -47.87 77.41 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 172.554 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -55.04 -56.62 17.77 Favored 'General case' 0 C--O 1.223 -0.336 0 CA-C-O 119.044 -0.503 . . . . 0.0 111.037 172.144 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 11.1 mt -45.95 -59.56 2.76 Favored 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 123.38 0.672 . . . . 0.0 110.299 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 15.5 tt -62.91 -50.76 78.36 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 C-N-CA 119.8 -0.76 . . . . 0.0 110.197 -177.008 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -59.35 -51.1 71.39 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.078 -1.014 . . . . 0.0 112.302 -175.648 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.1 -52.82 12.82 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.736 0.815 . . . . 0.0 110.208 -177.091 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -88.99 -18.15 27.97 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 -167.954 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 42.6 mt . . . . . 0 CA--C 1.526 0.054 0 C-N-CA 125.255 1.422 . . . . 0.0 107.874 172.843 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 18.1 p-10 . . . . . 0 C--O 1.225 -0.231 0 CA-C-O 119.675 -0.203 . . . . 0.0 111.054 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -42.52 -54.45 3.9 Favored 'General case' 0 C--O 1.225 -0.188 0 C-N-CA 123.912 0.885 . . . . 0.0 113.182 -169.906 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -59.42 -43.46 93.05 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.675 0.79 . . . . 0.0 110.848 -178.058 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 53' ' ' ILE . . . . . 0.56 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.2 mp -63.22 -52.53 57.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 N-CA-C 106.927 -1.508 . . . . 0.0 106.927 -178.389 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 84.7 t -56.72 -43.93 80.43 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 C-N-CA 124.248 1.019 . . . . 0.0 110.295 179.441 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -57.29 -53.7 55.17 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 119.023 0.829 . . . . 0.0 110.03 175.13 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 30.8 mt -51.88 -44.16 63.62 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 119.184 -0.436 . . . . 0.0 111.088 178.684 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 27.2 mmt -65.97 -65.31 0.69 Allowed 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 109.524 -0.546 . . . . 0.0 109.524 176.116 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -40.72 -43.09 1.89 Allowed 'General case' 0 CA--C 1.52 -0.196 0 C-N-CA 127.826 2.45 . . . . 0.0 111.89 -175.155 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -38.7 -48.76 1.52 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.21 1.004 . . . . 0.0 112.312 176.774 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.4 pp -61.85 -37.84 85.99 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 117.915 0.325 . . . . 0.0 111.479 -175.862 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -76.18 -47.15 25.19 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 179.266 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 14.1 ttm180 -50.57 -41.46 54.34 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.244 0.617 . . . . 0.0 110.283 177.073 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 . . . . . 0 CA--C 1.532 0.275 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -179.714 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 . . . . . 0 N--CA 1.451 -0.386 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 5.3 m -118.77 149.86 21.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 C-N-CA 124.991 1.316 . . . . 0.0 107.619 172.6 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -86.84 174.62 8.66 Favored 'General case' 0 CA--C 1.527 0.093 0 C-N-CA 124.272 1.029 . . . . 0.0 111.79 176.219 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 49.3 t80 -46.31 -61.91 1.58 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.717 0.807 . . . . 0.0 113.156 178.015 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 10.1 tp-100 -63.8 -32.49 74.02 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 120.183 1.356 . . . . 0.0 111.071 -177.354 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -62.61 -41.7 99.14 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 119.533 1.061 . . . . 0.0 110.938 175.079 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -57.96 -50.51 73.14 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.769 -0.582 . . . . 0.0 109.892 169.953 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 23.9 mm -60.18 -25.21 32.79 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 O-C-N 121.655 -0.653 . . . . 0.0 111.04 176.644 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 60.8 m -77.88 -32.94 52.15 Favored 'General case' 0 C--O 1.224 -0.24 0 O-C-N 120.917 -1.115 . . . . 0.0 110.37 173.4 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 30.8 t80 -58.46 -55.25 37.47 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 170.293 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 53.1 mt -63.09 -43.19 99.21 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 121.411 0.624 . . . . 0.0 111.7 178.09 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.88 -43.7 97.18 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.685 -0.966 . . . . 0.0 110.685 -177.63 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.29 -46.74 85.37 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 123.186 0.595 . . . . 0.0 110.031 174.253 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 13.8 tp -49.55 -56.18 10.82 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.426 0.631 . . . . 0.0 109.963 175.7 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 81' ' ' ALA . . . . . 0.425 ' HB1' HD11 ' A' ' 13' ' ' ILE . . . -51.81 -58.63 5.87 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 114.624 -1.171 . . . . 0.0 110.384 177.438 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 48.3 ttm -51.01 -48.4 61.43 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 124.889 1.276 . . . . 0.0 110.983 -177.746 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 76.6 mt -63.8 -66.07 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 CA-C-O 118.8 -0.619 . . . . 0.0 109.458 -178.494 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.381 0.7 OUTLIER -70.13 -31.29 68.74 Favored 'General case' 0 C--N 1.345 0.411 0 C-N-CA 117.941 -1.504 . . . . 0.0 112.715 -169.764 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 22.5 m-80 -80.61 71.73 7.5 Favored 'General case' 0 C--O 1.231 0.12 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 170.03 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -35.75 -45.22 0.37 Allowed 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 125.821 1.648 . . . . 0.0 112.158 178.172 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -35.74 -48.61 0.55 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.968 1.707 . . . . 0.0 113.426 174.91 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 96.4 mt . . . . . 0 CA--C 1.532 0.26 0 C-N-CA 123.002 0.521 . . . . 0.0 112.393 -176.332 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.284 0 CA-C-O 121.0 0.429 . . . . 0.0 110.917 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.4 t -44.87 155.63 0.39 Allowed Pre-proline 0 CA--C 1.534 0.336 0 C-N-CA 124.989 1.316 . . . . 0.0 111.08 169.441 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -50.23 -38.92 52.45 Favored 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 122.331 2.021 . . . . 0.0 111.533 169.47 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.9 mt -61.28 -54.0 49.62 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 118.649 0.659 . . . . 0.0 110.142 173.631 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -58.35 -38.96 78.26 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 117.656 0.207 . . . . 0.0 110.832 -175.821 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 15.1 tt0 -64.02 -52.3 60.12 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 124.783 1.233 . . . . 0.0 110.615 176.522 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.34 -45.42 91.29 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 121.367 0.603 . . . . 0.0 111.098 -178.126 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 68.0 mt -52.63 -52.63 25.43 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 169.405 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.4 -47.47 16.78 Favored Glycine 0 CA--C 1.528 0.893 0 C-N-CA 125.204 1.383 . . . . 0.0 112.202 174.732 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.6 mt -56.89 -55.31 36.08 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 117.95 0.875 . . . . 0.0 110.8 174.398 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.9 mp -59.37 -42.8 92.47 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 118.707 0.685 . . . . 0.0 111.7 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 73.5 mt -55.94 -56.82 10.71 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.167 0 C-N-CA 123.959 0.904 . . . . 0.0 109.746 172.659 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.29 -48.58 63.5 Favored Glycine 0 CA--C 1.522 0.518 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 -176.577 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 6.3 mm -54.73 -46.63 74.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 C-N-CA 123.396 0.678 . . . . 0.0 110.527 175.166 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -57.95 -53.45 58.04 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.645 0.736 . . . . 0.0 110.187 175.447 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.5 t-80 -57.43 -36.61 71.58 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.673 0.789 . . . . 0.0 111.302 -175.701 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.8 ttmm -52.86 -28.5 23.29 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.026 1.33 . . . . 0.0 111.87 178.25 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 61.3 m-85 -117.61 -73.52 0.64 Allowed 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.36 0.664 . . . . 0.0 109.602 176.926 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.455 -0.182 0 C-N-CA 124.513 1.125 . . . . 0.0 110.432 -175.683 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.5 p . . . . . 0 CA--C 1.53 0.191 0 CA-C-O 121.161 0.505 . . . . 0.0 112.178 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.48 -172.31 3.5 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.411 1.484 . . . . 0.0 108.178 171.178 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 8.6 t -148.17 -168.93 3.21 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 119.899 1.227 . . . . 0.0 111.828 178.584 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 49.0 pttt -35.15 -57.14 0.58 Allowed 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 128.992 2.917 . . . . 0.0 114.376 -173.342 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 23.1 ttmm -58.3 -52.37 65.88 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 -177.426 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -63.22 -40.48 97.59 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.274 -176.54 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.2 mt -59.77 -52.71 64.32 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 118.133 0.424 . . . . 0.0 111.178 175.221 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 35.3 mtmm -59.91 -43.36 94.92 Favored 'General case' 0 CA--C 1.531 0.212 0 O-C-N 122.202 -0.311 . . . . 0.0 110.706 -179.783 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 85.1 mt-10 -56.87 -60.22 3.89 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-O 118.746 -0.645 . . . . 0.0 109.8 172.266 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.0 mt -40.11 -60.6 1.02 Allowed 'General case' 0 N--CA 1.461 0.096 0 C-N-CA 124.481 1.113 . . . . 0.0 111.323 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 18.3 tt -60.94 -51.54 72.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 C-N-CA 120.179 -0.608 . . . . 0.0 110.29 -177.068 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -59.92 -47.55 85.3 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 118.868 0.758 . . . . 0.0 111.815 -175.403 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.2 mmpt? -67.95 -57.98 5.29 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 125.539 1.535 . . . . 0.0 109.642 -176.196 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -83.25 -49.23 9.63 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.198 -168.445 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 15.0 mt . . . . . 0 C--O 1.231 0.086 0 N-CA-C 108.056 -1.091 . . . . 0.0 108.056 171.207 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.1 p30 . . . . . 0 CA--C 1.528 0.133 0 CA-C-O 119.463 -0.303 . . . . 0.0 111.761 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.92 -60.5 0.16 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.124 1.77 . . . . 0.0 115.115 -176.2 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -62.55 -40.18 95.99 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-O 121.421 0.629 . . . . 0.0 110.845 -174.695 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.649 HD12 ' H ' ' A' ' 53' ' ' ILE . 3.4 mp -67.54 -48.42 76.94 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 -178.936 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 84.6 t -55.13 -44.66 75.53 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.36 0 CA-C-O 118.791 -0.623 . . . . 0.0 110.294 176.357 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -57.09 -52.68 64.33 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 119.339 0.972 . . . . 0.0 110.577 174.01 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 39.7 mt -52.99 -42.12 65.26 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 119.06 -0.495 . . . . 0.0 111.557 178.205 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 25.4 mmt -68.63 -61.56 1.77 Allowed 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.886 0.766 . . . . 0.0 109.554 176.973 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -46.12 -36.04 5.51 Favored 'General case' 0 CA--C 1.521 -0.143 0 C-N-CA 127.639 2.375 . . . . 0.0 111.973 -176.073 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -39.16 -56.75 1.43 Allowed 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.831 0.853 . . . . 0.0 111.605 170.733 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.25 -50.08 74.85 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 -176.89 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -58.25 -54.9 41.73 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.522 0.729 . . . . 0.0 111.189 -177.398 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 16.9 ptt180 . . . . . 0 N--CA 1.454 -0.266 0 O-C-N 122.493 -0.129 . . . . 0.0 110.789 -173.154 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.8 mp0 . . . . . 0 N--CA 1.451 -0.38 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 33.9 m -105.73 154.56 6.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 108.239 -1.022 . . . . 0.0 108.239 170.071 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -93.35 178.11 5.82 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 123.946 0.898 . . . . 0.0 110.967 177.114 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 50.3 t80 -40.51 -65.41 0.42 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.756 1.222 . . . . 0.0 112.538 172.627 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -61.21 -36.54 80.19 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 120.074 1.306 . . . . 0.0 111.844 -175.774 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 -66.55 -32.87 74.48 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 120.956 -1.09 . . . . 0.0 111.628 176.089 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -61.61 -51.89 66.65 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 121.19 -0.944 . . . . 0.0 108.559 168.499 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 21.3 mm -53.02 -39.69 33.91 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.364 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 177.713 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 54.6 m -59.1 -32.83 70.18 Favored 'General case' 0 C--O 1.226 -0.167 0 C-N-CA 123.744 0.818 . . . . 0.0 111.301 177.858 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -56.97 -50.55 72.3 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 171.692 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 42.9 mt -69.83 -39.82 76.24 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.018 0.927 . . . . 0.0 111.755 -177.375 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.72 -43.04 77.45 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 109.925 -1.27 . . . . 0.0 109.925 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.47 -45.95 88.44 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 122.104 -0.644 . . . . 0.0 110.202 173.876 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 10.0 tp -50.53 -57.69 7.54 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.04 0.536 . . . . 0.0 109.708 173.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -49.67 -54.14 20.36 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 124.072 0.949 . . . . 0.0 110.533 177.12 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 48.1 ttm -56.16 -47.94 77.27 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 124.248 1.019 . . . . 0.0 110.906 -177.116 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 85.5 mt -65.48 -55.43 20.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.477 -177.134 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.444 0.1 OUTLIER -75.22 -35.8 61.44 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 119.911 1.232 . . . . 0.0 112.997 -174.408 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 31.9 m-80 -81.75 72.85 8.8 Favored 'General case' 0 N--CA 1.461 0.105 0 O-C-N 120.942 -1.099 . . . . 0.0 108.123 170.653 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -30.17 -50.77 0.13 Allowed 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 126.633 1.973 . . . . 0.0 112.837 -179.277 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -34.11 -54.46 0.49 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.202 1.801 . . . . 0.0 113.146 174.264 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 94.7 mt . . . . . 0 N--CA 1.454 -0.249 0 C-N-CA 124.086 0.954 . . . . 0.0 113.245 -173.617 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.267 0 CA-C-O 121.267 0.556 . . . . 0.0 110.066 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -71.07 170.29 11.94 Favored Pre-proline 0 CA--C 1.539 0.526 0 C-N-CA 124.616 1.167 . . . . 0.0 111.101 -169.974 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -49.09 -49.01 16.37 Favored 'Trans proline' 0 N--CA 1.459 -0.554 0 C-N-CA 123.313 2.675 . . . . 0.0 112.428 179.426 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.5 mt -53.7 -50.9 64.88 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 119.32 -0.372 . . . . 0.0 111.551 172.731 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -59.38 -41.23 88.86 Favored 'General case' 0 C--O 1.227 -0.11 0 CA-C-N 118.539 0.608 . . . . 0.0 110.285 -177.376 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -61.66 -50.32 72.98 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 122.832 0.453 . . . . 0.0 110.69 176.667 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.21 -46.13 90.8 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.597 0.759 . . . . 0.0 111.164 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 78.5 mt -55.64 -50.87 64.18 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 172.083 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.69 -47.68 18.11 Favored Glycine 0 CA--C 1.527 0.787 0 C-N-CA 125.295 1.426 . . . . 0.0 111.896 174.438 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.3 mt -55.52 -54.59 42.06 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 117.538 0.669 . . . . 0.0 111.087 173.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.5 mp -58.21 -42.76 86.93 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 118.851 0.751 . . . . 0.0 111.616 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 97.4 mt -56.98 -53.32 44.48 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.168 0 C-N-CA 123.204 0.602 . . . . 0.0 110.082 173.59 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.77 -50.06 59.42 Favored Glycine 0 CA--C 1.522 0.525 0 N-CA-C 110.33 -1.108 . . . . 0.0 110.33 -178.423 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.8 mm -55.02 -45.84 76.96 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 C-N-CA 122.607 0.363 . . . . 0.0 110.28 175.48 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 39.7 t80 -56.94 -57.8 10.92 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 118.537 0.608 . . . . 0.0 110.111 176.351 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -51.66 -41.39 61.33 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 124.497 1.119 . . . . 0.0 111.128 -177.88 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 65.3 tttp -50.24 -32.63 17.12 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.337 1.055 . . . . 0.0 112.293 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -113.66 -55.17 2.54 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.495 0.718 . . . . 0.0 110.643 179.495 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 4.6 t . . . . . 0 C--O 1.232 0.139 0 C-N-CA 124.159 0.984 . . . . 0.0 111.247 -178.481 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 16.8 t-160 . . . . . 0 CA--C 1.539 0.523 0 CA-C-O 119.551 -0.261 . . . . 0.0 110.343 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 35.9 p -122.34 153.09 39.45 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 124.723 1.209 . . . . 0.0 112.609 -179.266 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -155.12 -174.68 5.08 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.672 1.589 . . . . 0.0 107.919 170.596 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 9.1 t -147.02 -167.47 2.78 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 120.155 1.343 . . . . 0.0 112.63 -177.877 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -39.96 -53.87 2.28 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 127.725 2.41 . . . . 0.0 113.474 -169.516 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -56.87 -50.57 72.09 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 123.015 0.526 . . . . 0.0 110.754 -179.042 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 19.4 mp0 -65.48 -38.1 88.78 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 -177.754 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 31.6 mt -66.45 -51.26 58.75 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 118.214 0.461 . . . . 0.0 111.268 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -54.91 -48.96 72.38 Favored 'General case' 0 N--CA 1.456 -0.175 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 176.385 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -52.61 -60.55 3.11 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 119.062 -0.494 . . . . 0.0 111.019 173.164 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 9.1 mt -43.04 -64.19 0.67 Allowed 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 124.466 1.106 . . . . 0.0 110.494 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 18.3 tt -63.22 -51.09 75.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 119.677 -0.809 . . . . 0.0 110.491 -174.737 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -67.91 -33.51 74.84 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.405 -0.809 . . . . 0.0 112.549 -171.267 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.43 -68.16 0.67 Allowed 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 174.856 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 60.8 mm-40 -64.25 -44.38 91.96 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 122.158 -0.339 . . . . 0.0 110.667 -168.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 26.3 mt . . . . . 0 N--CA 1.456 -0.144 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 172.235 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 . . . . . 0 C--O 1.226 -0.166 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -33.55 -60.83 0.35 Allowed 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 125.87 1.668 . . . . 0.0 114.142 -178.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 62.8 tt0 -58.91 -41.39 87.14 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-O 120.959 0.409 . . . . 0.0 110.852 -178.176 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 53' ' ' ILE . . . . . 0.516 ' H ' ' CD1' ' B' ' 53' ' ' ILE . 0.8 OUTLIER -64.59 -53.23 44.91 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.644 0 N-CA-C 106.665 -1.606 . . . . 0.0 106.665 -175.363 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 92.2 t -54.9 -45.58 75.62 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 C-N-CA 124.168 0.987 . . . . 0.0 110.082 177.005 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -55.75 -53.17 59.88 Favored 'General case' 0 CA--C 1.528 0.106 0 CA-C-N 118.538 0.608 . . . . 0.0 110.876 174.999 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 60.3 mt -55.85 -39.86 72.04 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 118.97 -0.538 . . . . 0.0 111.153 179.216 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 26.4 mmt -65.78 -65.6 0.66 Allowed 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.859 0.754 . . . . 0.0 109.186 174.871 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -39.3 -45.93 1.49 Allowed 'General case' 0 N--CA 1.461 0.124 0 C-N-CA 127.393 2.277 . . . . 0.0 111.892 -178.315 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -38.95 -48.3 1.57 Allowed 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 125.127 1.371 . . . . 0.0 112.227 178.015 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.2 pp -60.04 -39.89 87.52 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-O 119.641 -0.218 . . . . 0.0 110.827 -175.387 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -80.26 -42.81 22.47 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 123.005 0.522 . . . . 0.0 110.506 -178.824 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 54.7 ttm-85 -53.65 -45.73 70.32 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.328 0.651 . . . . 0.0 110.037 177.621 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 14.5 m-80 . . . . . 0 N--CA 1.456 -0.146 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 178.38 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 26.6 mp0 . . . . . 0 N--CA 1.452 -0.37 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 15.3 m -115.97 153.05 17.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 N-CA-C 106.106 -1.813 . . . . 0.0 106.106 167.369 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -96.82 174.83 6.6 Favored 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 123.085 0.554 . . . . 0.0 110.728 174.693 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -39.9 -60.23 1.05 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.065 0.946 . . . . 0.0 112.54 171.413 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 61.4 tp60 -60.48 -39.28 87.09 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 119.827 1.194 . . . . 0.0 111.835 -176.008 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 50.6 mm-40 -62.84 -41.37 99.32 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.322 -0.861 . . . . 0.0 111.339 174.141 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -56.7 -48.88 76.7 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.44 -0.787 . . . . 0.0 109.718 172.434 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 26.2 mm -59.42 -34.39 54.27 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 C-N-CA 123.725 0.81 . . . . 0.0 110.552 176.366 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 74.5 m -67.01 -41.91 85.88 Favored 'General case' 0 C--O 1.227 -0.121 0 O-C-N 121.479 -0.763 . . . . 0.0 110.204 174.373 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -56.72 -52.04 66.48 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.432 0.693 . . . . 0.0 109.225 174.86 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 44.0 mt -58.83 -44.64 90.96 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 122.246 -0.284 . . . . 0.0 111.59 175.042 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -59.5 -46.13 94.45 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 -179.366 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.09 -48.96 77.86 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 123.395 0.678 . . . . 0.0 109.804 176.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -50.69 -58.5 5.73 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-O 122.176 0.988 . . . . 0.0 109.733 176.201 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -48.69 -55.63 10.81 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 125.368 1.467 . . . . 0.0 110.742 178.126 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 19.7 ttp -66.58 -39.63 88.54 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.458 0.703 . . . . 0.0 112.087 -175.749 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 63.6 mt -65.49 -43.99 94.25 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 CA-C-O 118.02 -0.99 . . . . 0.0 110.079 -177.765 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.463 0.9 OUTLIER -78.75 -40.06 34.45 Favored 'General case' 0 C--N 1.347 0.459 0 C-N-CA 118.363 -1.335 . . . . 0.0 113.349 175.132 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -80.09 66.84 5.71 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 120.853 -1.154 . . . . 0.0 108.732 170.485 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -38.06 -42.65 0.67 Allowed 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.739 1.616 . . . . 0.0 113.328 -177.456 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -32.34 -55.07 0.33 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.25 1.82 . . . . 0.0 112.854 170.538 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 89.2 mt . . . . . 0 C--O 1.222 -0.368 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 -173.213 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.23 0 CA-C-O 121.546 0.688 . . . . 0.0 110.907 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.08 168.18 1.68 Allowed Pre-proline 0 CA--C 1.538 0.503 0 C-N-CA 126.598 1.959 . . . . 0.0 112.246 -178.384 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -49.05 -51.54 10.4 Favored 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 123.297 2.665 . . . . 0.0 112.491 174.703 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.423 HD23 ' HA ' ' A' ' 5' ' ' LEU . 5.8 mt -58.26 -49.18 78.02 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 119.436 -0.316 . . . . 0.0 110.705 176.597 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -54.99 -47.76 74.21 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -177.834 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 16.0 tt0 -59.72 -51.66 68.84 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.884 0.874 . . . . 0.0 110.757 177.35 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.33 -46.68 85.52 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.464 0.706 . . . . 0.0 111.725 -175.783 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 75.2 mt -54.21 -53.19 31.19 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 N-CA-C 107.958 -1.126 . . . . 0.0 107.958 170.478 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -45.6 -47.64 12.6 Favored Glycine 0 CA--C 1.529 0.92 0 C-N-CA 124.742 1.163 . . . . 0.0 112.087 175.07 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 mt -56.62 -54.3 47.63 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.785 0.834 . . . . 0.0 111.007 174.684 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.4 mp -60.03 -44.25 94.77 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.067 0.849 . . . . 0.0 111.743 -179.215 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 67.7 mt -56.18 -55.67 17.35 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 C-N-CA 123.238 0.615 . . . . 0.0 109.733 173.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -52.77 -50.73 48.54 Favored Glycine 0 CA--C 1.521 0.417 0 N-CA-C 110.03 -1.228 . . . . 0.0 110.03 -177.622 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.7 mm -55.0 -48.44 75.74 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 C-N-CA 123.03 0.532 . . . . 0.0 110.443 176.054 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -55.16 -56.15 23.2 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 118.668 0.667 . . . . 0.0 110.245 177.413 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -64.28 -31.96 73.37 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 123.19 0.596 . . . . 0.0 111.5 -172.812 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -49.77 -43.84 48.48 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.544 1.138 . . . . 0.0 110.828 176.824 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 94.5 m-85 -96.12 -56.05 2.77 Favored 'General case' 0 CA--C 1.529 0.138 0 N-CA-C 109.624 -0.509 . . . . 0.0 109.624 179.136 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.8 m . . . . . 0 C--O 1.224 -0.267 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -175.572 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.4 p . . . . . 0 N--CA 1.447 -0.616 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -161.61 163.2 30.12 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.829 0.852 . . . . 0.0 108.73 168.77 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 10.6 t -116.96 -169.64 1.68 Allowed 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.229 0.922 . . . . 0.0 112.639 -174.063 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -38.61 -65.49 0.35 Allowed 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 128.942 2.897 . . . . 0.0 113.252 -171.619 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 30.1 tttm -56.14 -43.54 78.36 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.386 0.674 . . . . 0.0 110.742 -174.427 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -66.41 -39.44 88.99 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 123.697 0.799 . . . . 0.0 110.387 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 45.8 mt -63.1 -50.65 69.66 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 118.123 0.42 . . . . 0.0 110.822 174.394 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 36.3 mttp -53.42 -49.26 67.69 Favored 'General case' 0 C--O 1.233 0.185 0 C-N-CA 123.584 0.754 . . . . 0.0 110.061 176.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 53.2 tt0 -51.56 -69.56 0.11 Allowed 'General case' 0 C--O 1.223 -0.335 0 CA-C-O 118.308 -0.853 . . . . 0.0 109.196 171.334 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.6 mt -35.26 -63.47 0.33 Allowed 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 124.126 0.971 . . . . 0.0 112.476 178.67 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 14.7 tt -63.85 -45.27 97.54 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-O 119.118 -0.468 . . . . 0.0 110.579 -171.934 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.0 tt0 -70.42 -44.75 67.28 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 118.856 0.753 . . . . 0.0 111.904 -176.433 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.7 mmpt? -54.85 -58.35 7.94 Favored 'General case' 0 N--CA 1.458 -0.069 0 C-N-CA 124.236 1.015 . . . . 0.0 109.103 175.842 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -79.56 -66.66 0.84 Allowed 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.715 -171.126 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 95.9 mt . . . . . 0 N--CA 1.453 -0.31 0 O-C-N 121.615 -0.678 . . . . 0.0 109.916 -175.067 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 . . . . . 0 CA--C 1.534 0.338 0 N-CA-C 114.552 1.316 . . . . 0.0 114.552 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -38.64 -56.2 1.35 Allowed 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.442 1.497 . . . . 0.0 113.737 -173.161 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -63.44 -38.93 93.04 Favored 'General case' 0 N--CA 1.461 0.106 0 CA-C-O 121.267 0.556 . . . . 0.0 110.709 -174.884 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.656 HD12 ' H ' ' A' ' 53' ' ' ILE . 3.0 mp -68.65 -49.47 64.42 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.705 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 -175.484 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 71.6 t -53.5 -47.39 59.6 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 C-N-CA 123.342 0.657 . . . . 0.0 110.172 173.371 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.54 -52.63 63.06 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.73 0.695 . . . . 0.0 110.607 176.212 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.1 mt -55.27 -40.47 71.03 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.266 0.626 . . . . 0.0 111.547 -178.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.24 -61.49 1.77 Allowed 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 118.563 0.62 . . . . 0.0 109.645 174.491 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -46.61 -34.0 4.63 Favored 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 126.5 1.92 . . . . 0.0 112.269 -176.714 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -38.12 -50.39 1.38 Allowed 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 125.302 1.441 . . . . 0.0 111.43 173.212 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -53.03 -60.53 3.17 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 122.81 0.444 . . . . 0.0 109.872 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -63.34 -40.28 96.85 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.569 0.747 . . . . 0.0 111.467 -174.631 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.534 0.344 0 CA-C-O 119.485 -0.293 . . . . 0.0 111.761 -173.642 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.5 pm0 . . . . . 0 N--CA 1.448 -0.539 0 CA-C-O 120.684 0.278 . . . . 0.0 111.312 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 20.5 m -107.69 149.1 11.31 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 C-N-CA 126.034 1.734 . . . . 0.0 108.303 174.349 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -87.68 168.93 12.56 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.335 0.654 . . . . 0.0 111.283 175.214 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -33.59 -63.0 0.27 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.688 1.195 . . . . 0.0 112.963 172.024 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 45.2 tp60 -62.49 -31.46 72.22 Favored 'General case' 0 CA--C 1.533 0.292 0 O-C-N 120.753 -1.217 . . . . 0.0 111.839 -174.186 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -71.8 -37.74 70.36 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.261 -0.899 . . . . 0.0 110.199 176.2 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -56.67 -49.86 73.81 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 169.666 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 26.9 mm -56.59 -41.43 73.5 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 175.892 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 60.1 m -59.22 -41.7 89.26 Favored 'General case' 0 C--O 1.225 -0.196 0 CA-C-N 118.821 0.737 . . . . 0.0 110.489 177.579 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -54.46 -54.62 38.46 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 122.027 -0.421 . . . . 0.0 109.885 174.111 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 62.4 mt -61.12 -40.7 94.78 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.95 -44.48 67.66 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 110.386 -1.086 . . . . 0.0 110.386 -176.859 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.02 -44.3 93.0 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 117.942 0.871 . . . . 0.0 110.302 175.387 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 14.4 tp -50.94 -57.1 9.41 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 121.278 0.561 . . . . 0.0 109.659 173.109 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.36 -47.32 66.21 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.312 178.114 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 37.2 ttm -58.49 -46.64 86.25 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 123.963 0.905 . . . . 0.0 110.798 -179.105 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 63.6 mt -63.51 -62.99 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.162 0 CA-C-O 118.554 -0.736 . . . . 0.0 109.886 176.873 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.452 0.2 OUTLIER -68.16 -34.74 76.88 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 118.025 -1.47 . . . . 0.0 112.731 -169.868 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -83.91 66.84 9.34 Favored 'General case' 0 N--CA 1.462 0.149 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 167.628 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 82.9 mt-10 -41.78 -39.31 1.7 Allowed 'General case' 0 N--CA 1.463 0.209 0 C-N-CA 125.904 1.681 . . . . 0.0 112.028 -173.161 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.17 -50.94 0.31 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.848 1.659 . . . . 0.0 113.419 171.519 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 59.5 mt . . . . . 0 CA--C 1.533 0.326 0 C-N-CA 123.926 0.89 . . . . 0.0 113.32 -174.663 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.255 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 3.8 m -55.66 161.5 3.16 Favored Pre-proline 0 CA--C 1.54 0.559 0 C-N-CA 123.211 0.605 . . . . 0.0 110.797 174.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -44.26 -49.64 8.58 Favored 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 123.615 2.877 . . . . 0.0 113.285 178.785 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 6.1 mt -53.99 -47.82 71.02 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-O 119.643 -0.218 . . . . 0.0 111.466 174.158 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -64.93 -42.29 94.8 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 109.8 -0.445 . . . . 0.0 109.8 -174.679 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 tp60 -61.46 -46.69 89.01 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 122.179 0.192 . . . . 0.0 110.682 175.48 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.84 -46.88 83.06 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.411 0.685 . . . . 0.0 111.165 -178.369 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 57.8 mt -52.54 -51.99 29.95 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 C-N-CA 124.177 0.991 . . . . 0.0 108.448 169.954 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.68 -48.46 23.17 Favored Glycine 0 CA--C 1.528 0.874 0 C-N-CA 124.971 1.272 . . . . 0.0 111.654 175.13 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 mt -56.03 -54.51 44.03 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 117.492 0.646 . . . . 0.0 111.027 174.362 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 mp -57.94 -44.81 87.16 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.053 0.842 . . . . 0.0 111.666 -179.48 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 96.2 mt -56.32 -54.01 33.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 C-N-CA 123.171 0.588 . . . . 0.0 110.263 173.721 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.27 -50.19 57.01 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 110.293 -1.123 . . . . 0.0 110.293 -178.045 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 9.1 mm -53.85 -48.52 62.12 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 C-N-CA 123.684 0.794 . . . . 0.0 110.549 176.019 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -55.47 -62.28 1.78 Allowed 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.326 0.584 . . . . 0.0 109.686 176.571 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -52.7 -41.16 63.64 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.312 1.045 . . . . 0.0 111.427 -174.572 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -47.58 -39.96 17.97 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.713 1.205 . . . . 0.0 111.43 178.257 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -96.89 -62.48 1.25 Allowed 'General case' 0 C--O 1.233 0.199 0 N-CA-C 109.044 -0.725 . . . . 0.0 109.044 178.446 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.4 m . . . . . 0 C--O 1.232 0.172 0 C-N-CA 124.135 0.974 . . . . 0.0 111.975 -173.516 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 45.2 m80 . . . . . 0 CA--C 1.537 0.476 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -138.63 160.22 40.14 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 126.039 1.735 . . . . 0.0 107.412 176.724 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.53 176.87 11.12 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-O 118.998 -0.525 . . . . 0.0 110.938 176.369 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 39.1 p -125.71 174.0 8.62 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.701 0.682 . . . . 0.0 112.491 -174.408 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 11.3 ptpt -26.39 -56.65 0.08 Allowed 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 127.889 2.476 . . . . 0.0 113.981 170.313 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -53.78 -52.58 59.79 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 123.136 0.574 . . . . 0.0 110.551 -178.424 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 26.0 mp0 -67.8 -37.2 81.7 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 118.693 -0.67 . . . . 0.0 110.391 -178.672 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 62.3 mt -62.11 -51.96 65.8 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.266 0.939 . . . . 0.0 111.108 178.11 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -61.93 -42.13 98.75 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 122.987 0.515 . . . . 0.0 110.002 -179.513 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 58.9 mt-10 -54.87 -67.01 0.3 Allowed 'General case' 0 C--O 1.222 -0.353 0 CA-C-O 119.302 -0.38 . . . . 0.0 110.299 169.731 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 12.7 mt -37.61 -63.38 0.46 Allowed 'General case' 0 CA--C 1.52 -0.184 0 C-N-CA 125.98 1.712 . . . . 0.0 111.224 -179.284 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 13.6 tt -57.26 -54.38 31.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.158 -174.667 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 -73.7 -31.32 63.35 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.994 0.738 . . . . 0.0 112.994 -170.417 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.9 -56.98 4.2 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 176.336 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 68.9 mm-40 -77.06 -26.65 53.8 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 117.911 -1.042 . . . . 0.0 112.628 -168.64 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 95.5 mt . . . . . 0 C--N 1.339 0.11 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 167.538 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 . . . . . 0 C--O 1.225 -0.229 0 N-CA-C 114.111 1.152 . . . . 0.0 114.111 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -28.7 -60.13 0.13 Allowed 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 126.453 1.901 . . . . 0.0 113.561 -178.695 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -67.65 -39.81 84.56 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-O 120.889 0.376 . . . . 0.0 110.603 -172.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 53' ' ' ILE . . . . . 0.501 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.1 mp -62.05 -54.1 38.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 N-CA-C 106.931 -1.507 . . . . 0.0 106.931 179.213 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 70.9 t -58.71 -40.99 81.14 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 C-N-CA 124.452 1.101 . . . . 0.0 110.116 -177.813 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -58.19 -54.67 44.35 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 118.916 0.78 . . . . 0.0 110.307 172.198 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 36.7 mt -51.87 -41.87 62.21 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 119.231 -0.414 . . . . 0.0 111.606 178.899 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 24.0 mmt -69.56 -64.56 0.86 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 121.533 0.683 . . . . 0.0 109.988 177.331 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.65 -25.5 62.82 Favored 'General case' 0 N--CA 1.457 -0.088 0 C-N-CA 124.791 1.236 . . . . 0.0 112.293 -169.0 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -41.29 -50.09 3.69 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 124.273 1.029 . . . . 0.0 111.166 168.738 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 78.4 mt -59.08 -53.28 60.15 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -174.847 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -60.7 -44.03 97.07 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 124.582 1.153 . . . . 0.0 110.948 -179.067 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 29.4 ttm105 -59.05 -52.75 64.41 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.407 0.683 . . . . 0.0 110.108 178.457 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 . . . . . 0 N--CA 1.454 -0.232 0 CA-C-N 116.663 -0.244 . . . . 0.0 110.372 -171.778 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 . . . . . 0 CA--C 1.531 0.213 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 15.2 m -106.39 150.96 8.57 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 C-N-CA 124.697 1.199 . . . . 0.0 108.807 174.973 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -90.82 174.14 7.62 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.861 0.864 . . . . 0.0 110.826 173.81 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -39.06 -62.11 0.68 Allowed 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.019 1.328 . . . . 0.0 112.883 173.566 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 39.0 tp60 -61.84 -35.33 77.94 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 119.603 1.092 . . . . 0.0 111.605 -173.111 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -66.21 -43.42 86.77 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.667 -0.646 . . . . 0.0 110.139 176.175 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -54.67 -48.33 72.5 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.867 -0.52 . . . . 0.0 109.896 171.806 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 25.5 mm -58.55 -37.8 66.95 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 O-C-N 121.889 -0.507 . . . . 0.0 110.355 175.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 37.5 m -62.99 -42.86 99.96 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 121.521 -0.737 . . . . 0.0 110.203 175.816 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -56.14 -55.07 37.54 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 122.958 0.503 . . . . 0.0 110.017 176.046 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 39.6 mt -60.64 -44.28 96.58 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 122.188 -0.32 . . . . 0.0 111.861 177.94 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.56 -39.64 95.64 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 111.059 -0.816 . . . . 0.0 111.059 -175.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.32 -50.53 72.56 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 117.541 0.67 . . . . 0.0 109.425 173.118 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -49.39 -54.69 16.07 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 121.445 0.64 . . . . 0.0 109.894 174.658 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.08 -56.85 11.8 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 124.487 1.115 . . . . 0.0 110.716 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 11.4 ttp -60.74 -45.55 93.85 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.656 0.782 . . . . 0.0 111.315 -177.484 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 63.3 mt -61.97 -47.75 91.74 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-O 117.916 -1.04 . . . . 0.0 110.216 -175.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.453 0.0 OUTLIER -83.2 -31.58 27.0 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 179.89 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 32.0 m-80 -80.11 77.55 6.81 Favored 'General case' 0 N--CA 1.462 0.126 0 O-C-N 120.715 -1.241 . . . . 0.0 108.749 173.709 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 55.0 mm-40 -36.71 -43.29 0.41 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 126.024 1.729 . . . . 0.0 112.466 178.008 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -41.46 -41.19 1.99 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 126.185 1.794 . . . . 0.0 113.734 176.419 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 90.5 mt . . . . . 0 CA--C 1.531 0.23 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -177.278 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.196 0 CA-C-O 121.894 0.854 . . . . 0.0 109.706 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 13.6 m -60.01 160.87 14.2 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 125.93 1.692 . . . . 0.0 109.717 -177.659 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo -48.61 -49.41 14.79 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.977 2.451 . . . . 0.0 112.92 -176.779 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.6 mt -58.83 -41.25 86.45 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 173.374 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -63.04 -40.79 98.77 Favored 'General case' 0 C--O 1.225 -0.201 0 CA-C-N 118.979 0.809 . . . . 0.0 109.389 -178.902 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -60.24 -51.87 67.72 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 122.753 0.421 . . . . 0.0 110.427 174.487 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.56 -46.87 88.59 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 121.563 0.697 . . . . 0.0 111.639 -177.987 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 60.6 mt -55.23 -50.8 61.6 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 171.582 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -48.06 -46.96 26.79 Favored Glycine 0 CA--C 1.526 0.747 0 C-N-CA 125.157 1.361 . . . . 0.0 111.688 176.029 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.6 mt -54.85 -55.93 24.95 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.775 0.83 . . . . 0.0 110.916 173.874 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 11.0 mp -60.35 -43.87 96.08 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.546 -0.721 . . . . 0.0 111.914 -179.025 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 96.1 mt -55.34 -56.16 13.04 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.206 0 C-N-CA 123.226 0.611 . . . . 0.0 109.592 173.431 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -52.77 -49.72 52.78 Favored Glycine 0 CA--C 1.522 0.483 0 N-CA-C 110.356 -1.098 . . . . 0.0 110.356 -177.271 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 7.9 mm -53.4 -46.94 59.05 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 C-N-CA 122.694 0.398 . . . . 0.0 110.84 176.216 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 29.3 t80 -58.87 -60.35 3.98 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 121.939 0.876 . . . . 0.0 109.8 176.342 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.1 t-80 -55.41 -34.14 64.15 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 125.468 1.507 . . . . 0.0 111.871 -172.466 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 65.3 tttp -46.68 -36.69 7.37 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.586 1.154 . . . . 0.0 111.567 174.425 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -104.88 -62.61 1.32 Allowed 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 176.002 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.5 m . . . . . 0 C--O 1.226 -0.138 0 C-N-CA 124.74 1.216 . . . . 0.0 112.705 -171.911 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 36.4 p . . . . . 0 N--CA 1.466 0.369 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -145.65 -172.84 3.98 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.413 1.085 . . . . 0.0 108.92 169.42 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 96.5 p -147.21 -179.86 7.13 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.813 1.188 . . . . 0.0 113.188 -170.987 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -19.18 -71.3 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 128.922 2.889 . . . . 0.0 115.132 -178.287 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.1 ttpt -60.38 -44.76 95.34 Favored 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 121.88 -0.512 . . . . 0.0 109.879 -172.719 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -59.97 -40.98 90.95 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 123.199 0.6 . . . . 0.0 110.084 177.616 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 38.0 mt -65.2 -49.99 67.61 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 118.121 0.419 . . . . 0.0 111.365 178.862 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -57.6 -51.25 70.25 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 178.075 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 59.1 tt0 -48.4 -57.75 5.6 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.988 1.315 . . . . 0.0 109.751 173.462 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.3 mt -46.36 -72.94 0.05 OUTLIER 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 124.306 1.043 . . . . 0.0 110.247 176.017 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 18.8 tt -55.54 -42.53 68.75 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 CA-C-N 117.787 0.267 . . . . 0.0 110.533 -169.657 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -56.38 -51.37 68.58 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.83 -0.544 . . . . 0.0 111.618 174.544 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.29 -54.07 24.1 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 118.12 0.418 . . . . 0.0 110.596 -174.04 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.14 -9.12 43.61 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -169.771 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 23.1 mt . . . . . 0 N--CA 1.456 -0.158 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 170.801 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 . . . . . 0 N--CA 1.465 0.298 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -32.62 -62.01 0.25 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.535 1.534 . . . . 0.0 114.563 -174.665 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -65.23 -36.0 82.79 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-O 120.796 0.331 . . . . 0.0 111.093 -174.858 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.566 ' N ' HD12 ' A' ' 53' ' ' ILE . 1.3 mp -66.59 -52.75 42.55 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 N-CA-C 105.941 -1.874 . . . . 0.0 105.941 -176.267 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 86.4 t -53.38 -45.01 56.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 C-N-CA 124.173 0.989 . . . . 0.0 109.922 174.735 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.1 -50.39 73.65 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 118.92 0.782 . . . . 0.0 111.444 176.181 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 54.9 mt -56.06 -39.87 72.7 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 119.151 -0.452 . . . . 0.0 111.038 178.037 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 24.7 mmt -67.49 -60.35 2.64 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.808 0.731 . . . . 0.0 109.457 175.635 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -46.83 -40.17 13.31 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 126.89 2.076 . . . . 0.0 111.697 -176.23 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -38.78 -48.98 1.58 Allowed 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 124.908 1.283 . . . . 0.0 111.842 174.891 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 73.1 mt -58.45 -54.23 49.41 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.792 -0.448 . . . . 0.0 109.792 -176.31 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -66.01 -40.15 90.86 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 124.092 0.957 . . . . 0.0 111.275 -178.029 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 17.4 ttm180 . . . . . 0 N--CA 1.451 -0.375 0 C-N-CA 123.895 0.878 . . . . 0.0 109.585 178.254 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 . . . . . 0 N--CA 1.452 -0.327 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 11.0 m -80.37 139.79 17.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 -179.047 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -83.17 172.09 13.0 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 120.988 0.423 . . . . 0.0 111.232 176.385 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -41.61 -59.48 1.62 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.577 1.151 . . . . 0.0 111.827 173.08 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 36.0 tp60 -61.12 -38.87 87.89 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 119.11 0.868 . . . . 0.0 111.564 -175.6 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -60.94 -44.6 97.02 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.532 -0.73 . . . . 0.0 110.807 174.347 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -58.08 -47.62 82.65 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 121.699 -0.626 . . . . 0.0 109.961 174.115 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.7 mm -59.08 -33.51 50.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 O-C-N 121.704 -0.622 . . . . 0.0 110.174 175.315 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 41.8 m -69.24 -36.2 76.92 Favored 'General case' 0 C--O 1.224 -0.287 0 O-C-N 121.448 -0.782 . . . . 0.0 110.402 173.617 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -58.52 -56.88 16.4 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 173.85 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 33.1 mt -60.7 -45.2 95.09 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 122.451 0.3 . . . . 0.0 111.781 178.461 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.65 -43.97 95.64 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.742 -0.943 . . . . 0.0 110.742 -176.581 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.02 -45.48 81.36 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 121.961 -0.729 . . . . 0.0 110.139 176.521 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -48.73 -55.71 10.66 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.469 0.708 . . . . 0.0 109.872 171.931 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -53.37 -54.8 31.4 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 124.28 1.032 . . . . 0.0 111.092 178.114 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 21.7 ttp -63.02 -36.26 82.97 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 123.995 0.918 . . . . 0.0 111.774 -176.83 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 83.1 mt -64.31 -60.66 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 176.134 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.439 0.2 OUTLIER -67.79 -35.7 79.11 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 117.188 -1.805 . . . . 0.0 112.638 -173.374 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 44.6 m-80 -80.1 65.8 5.37 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 169.414 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -35.38 -46.94 0.4 Allowed 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 126.413 1.885 . . . . 0.0 111.968 -176.26 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -27.64 -58.25 0.11 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.711 2.004 . . . . 0.0 113.307 171.275 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.7 mt . . . . . 0 CA--C 1.533 0.323 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -172.243 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.216 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 46.1 p -69.66 166.7 28.85 Favored Pre-proline 0 N--CA 1.452 -0.366 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 171.716 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_exo -49.37 -44.95 32.43 Favored 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 122.438 2.092 . . . . 0.0 110.986 168.616 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.431 HD23 ' HA ' ' B' ' 5' ' ' LEU . 2.1 mt -56.28 -58.36 8.3 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 118.621 -0.704 . . . . 0.0 112.475 170.678 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -56.61 -38.8 72.56 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 119.162 0.892 . . . . 0.0 110.481 -174.343 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 -61.4 -51.47 68.61 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.952 0.901 . . . . 0.0 111.194 173.843 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.73 -46.2 90.66 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.631 0.729 . . . . 0.0 111.362 -178.364 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 82.4 mt -53.03 -52.1 32.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 C-N-CA 124.597 1.159 . . . . 0.0 108.048 169.943 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.53 -47.66 22.93 Favored Glycine 0 CA--C 1.527 0.818 0 C-N-CA 124.94 1.257 . . . . 0.0 111.903 174.211 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.6 mt -54.48 -56.47 18.42 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.719 0.808 . . . . 0.0 110.408 173.292 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -56.79 -43.31 80.77 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 118.663 0.665 . . . . 0.0 111.69 -179.531 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 99.3 mt -58.42 -54.41 33.26 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 C-N-CA 123.007 0.523 . . . . 0.0 110.681 173.995 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.76 -49.93 67.08 Favored Glycine 0 CA--C 1.522 0.519 0 N-CA-C 110.313 -1.115 . . . . 0.0 110.313 -177.156 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 8.1 mm -51.25 -51.66 22.23 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 C-N-CA 124.182 0.993 . . . . 0.0 109.843 173.812 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -54.17 -56.44 18.21 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 110.172 -0.306 . . . . 0.0 110.172 177.853 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -58.04 -38.15 75.7 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 123.754 0.821 . . . . 0.0 111.241 -175.236 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 64.2 tttm -50.37 -42.82 53.92 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.824 0.849 . . . . 0.0 111.118 179.518 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -98.32 -30.42 12.6 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 122.781 0.432 . . . . 0.0 112.029 -178.365 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 14.2 m . . . . . 0 C--O 1.226 -0.133 0 O-C-N 121.861 -0.524 . . . . 0.0 110.925 178.92 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 14.7 m80 . . . . . 0 CA--C 1.537 0.454 0 N-CA-C 110.232 -0.285 . . . . 0.0 110.232 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 53.8 p -134.06 166.97 21.49 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 125.298 1.439 . . . . 0.0 107.522 169.602 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -160.77 160.25 31.05 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 171.55 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -100.93 176.74 5.17 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.42 1.488 . . . . 0.0 113.009 -169.589 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -42.72 -52.17 5.04 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 126.533 1.933 . . . . 0.0 113.825 179.13 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -62.81 -47.63 82.62 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 -175.22 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -59.29 -40.56 86.57 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.701 0.8 . . . . 0.0 111.187 177.987 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 35.5 mt -64.44 -48.1 76.58 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 118.471 0.578 . . . . 0.0 111.311 175.964 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 9.0 mtmp? -57.86 -43.24 85.83 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.951 -0.468 . . . . 0.0 110.297 175.968 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -55.28 -57.91 9.88 Favored 'General case' 0 C--O 1.224 -0.245 0 CA-C-O 119.189 -0.434 . . . . 0.0 110.553 171.076 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 10.7 mt -44.22 -59.39 2.38 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 123.898 0.879 . . . . 0.0 110.242 -179.643 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 16.0 tt -64.64 -51.43 67.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 C-N-CA 119.683 -0.807 . . . . 0.0 110.297 -177.47 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.24 -32.59 74.24 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 120.959 -1.088 . . . . 0.0 112.887 -172.42 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.11 -58.5 2.54 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.194 0.998 . . . . 0.0 109.937 177.611 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 49.7 mm-40 -82.78 -24.79 33.27 Favored 'General case' 0 CA--C 1.529 0.171 0 O-C-N 121.449 -0.782 . . . . 0.0 112.966 -168.395 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 58.4 mt . . . . . 0 N--CA 1.46 0.065 0 C-N-CA 124.958 1.303 . . . . 0.0 108.02 169.593 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 . . . . . 0 CA--C 1.528 0.13 0 N-CA-C 114.777 1.399 . . . . 0.0 114.777 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.4 -60.08 0.15 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.682 1.593 . . . . 0.0 114.45 -176.225 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 62.3 tt0 -63.55 -44.06 95.26 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 122.756 0.422 . . . . 0.0 110.81 -176.731 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 53' ' ' ILE . . . . . 0.484 ' H ' ' CD1' ' B' ' 53' ' ' ILE . 1.2 mp -59.96 -50.06 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.459 0 N-CA-C 106.461 -1.681 . . . . 0.0 106.461 -176.708 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 75.0 t -55.96 -54.62 24.84 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.535 176.528 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.41 -51.04 28.56 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 118.555 0.616 . . . . 0.0 111.764 -179.641 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 27.7 mt -52.19 -40.86 62.11 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 122.703 0.401 . . . . 0.0 112.06 -178.919 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -81.06 -58.48 3.05 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.625 0.77 . . . . 0.0 110.582 179.751 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -40.98 -42.61 1.93 Allowed 'General case' 0 N--CA 1.462 0.133 0 C-N-CA 126.484 1.914 . . . . 0.0 111.418 177.84 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -38.41 -51.64 1.55 Allowed 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 125.123 1.369 . . . . 0.0 112.897 174.693 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -58.15 -50.54 73.15 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -174.731 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -64.49 -49.04 72.92 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.683 0.393 . . . . 0.0 110.445 179.757 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 13.7 ttm180 -50.99 -54.2 26.49 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 124.113 0.965 . . . . 0.0 110.073 -179.154 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 13.3 m120 . . . . . 0 N--CA 1.453 -0.319 0 CA-C-O 119.135 -0.46 . . . . 0.0 110.638 -179.513 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 . . . . . 0 N--CA 1.453 -0.291 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 19.7 m -79.06 145.8 8.91 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.225 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 -177.328 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -82.77 177.7 8.54 Favored 'General case' 0 CA--C 1.528 0.133 0 C-N-CA 123.925 0.89 . . . . 0.0 111.377 177.752 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -48.16 -63.31 1.11 Allowed 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 123.963 0.905 . . . . 0.0 112.209 178.275 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 43.2 tp60 -61.99 -34.18 75.69 Favored 'General case' 0 CA--C 1.531 0.245 0 O-C-N 121.138 -0.976 . . . . 0.0 111.13 -174.03 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 61.3 mt-10 -63.24 -45.54 91.11 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 121.569 -0.707 . . . . 0.0 110.75 174.932 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -54.61 -49.11 71.24 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 121.645 -0.659 . . . . 0.0 109.98 170.799 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 22.4 mm -57.94 -34.47 48.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 O-C-N 121.689 -0.632 . . . . 0.0 110.343 176.417 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 33.2 m -67.9 -39.74 83.57 Favored 'General case' 0 CA--C 1.53 0.206 0 O-C-N 121.343 -0.848 . . . . 0.0 110.541 175.425 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -53.8 -55.19 28.7 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.656 -0.652 . . . . 0.0 109.63 171.614 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 34.9 mt -60.16 -45.32 93.46 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.791 178.707 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.0 -42.25 98.29 Favored Glycine 0 CA--C 1.524 0.623 0 N-CA-C 110.787 -0.925 . . . . 0.0 110.787 -176.507 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.43 -50.17 68.59 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 123.273 0.629 . . . . 0.0 110.108 175.719 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -48.14 -56.66 7.3 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 121.775 0.798 . . . . 0.0 110.136 173.521 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.81 -54.1 39.01 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.015 1.326 . . . . 0.0 110.695 179.825 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 50.1 ttm -57.32 -48.67 78.37 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.232 1.013 . . . . 0.0 110.619 -179.436 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 61.9 mt -63.36 -51.43 71.01 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-O 117.585 -1.198 . . . . 0.0 109.653 -174.212 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.436 0.8 OUTLIER -73.58 -39.69 64.46 Favored 'General case' 0 C--N 1.347 0.482 0 C-N-CA 118.15 -1.42 . . . . 0.0 112.707 -179.561 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -80.59 63.09 4.9 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 169.06 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -51.33 -25.22 5.58 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.102 0.961 . . . . 0.0 113.058 -172.963 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -39.55 -50.51 2.2 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.832 1.253 . . . . 0.0 111.49 167.107 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 86.1 mt . . . . . 0 CA--C 1.53 0.211 0 C-N-CA 124.689 1.196 . . . . 0.0 113.535 -176.748 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.198 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 70.0 p -54.4 162.93 1.44 Allowed Pre-proline 0 CA--C 1.533 0.319 0 C-N-CA 124.348 1.059 . . . . 0.0 111.21 174.03 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -47.99 -46.59 21.55 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.356 2.038 . . . . 0.0 110.676 168.941 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.466 HD23 ' HA ' ' A' ' 5' ' ' LEU . 4.7 mt -55.11 -59.28 4.98 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-O 119.26 -0.4 . . . . 0.0 111.716 173.257 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -52.55 -48.14 66.32 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.13 0.423 . . . . 0.0 110.336 -176.021 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.85 -49.98 75.27 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.499 0.72 . . . . 0.0 110.258 -179.558 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.49 -45.69 91.87 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.949 0.9 . . . . 0.0 111.99 -177.945 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 84.8 mt -55.14 -50.92 59.91 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 N-CA-C 107.737 -1.209 . . . . 0.0 107.737 171.574 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -45.56 -49.14 11.92 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 124.505 1.05 . . . . 0.0 112.033 172.449 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.6 mt -56.88 -55.15 38.16 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.055 0.927 . . . . 0.0 111.303 175.49 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -59.85 -44.42 94.13 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 119.293 0.951 . . . . 0.0 111.505 -177.491 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 77.8 mt -56.45 -53.71 37.25 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 123.523 0.729 . . . . 0.0 109.948 173.738 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -53.81 -49.29 58.9 Favored Glycine 0 CA--C 1.522 0.47 0 C-N-CA 124.443 1.021 . . . . 0.0 110.572 -179.124 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 7.3 mm -57.76 -44.53 86.1 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 C-N-CA 122.986 0.514 . . . . 0.0 110.185 176.588 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 39.6 t80 -55.81 -54.89 39.0 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 118.797 0.726 . . . . 0.0 109.89 175.647 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 37.4 m-70 -64.9 -26.78 68.46 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 113.48 0.918 . . . . 0.0 113.48 -177.029 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.2 ttmm -52.82 -26.11 13.53 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 118.694 0.679 . . . . 0.0 110.751 170.403 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -127.51 41.7 3.46 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.715 1.206 . . . . 0.0 109.118 173.174 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 31.9 m . . . . . 0 C--N 1.348 0.512 0 C-N-CA 125.799 1.64 . . . . 0.0 112.408 -177.557 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 22.8 p . . . . . 0 CA--C 1.532 0.272 0 N-CA-C 113.256 0.835 . . . . 0.0 113.256 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -137.44 158.76 43.71 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.543 1.137 . . . . 0.0 110.77 176.824 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 88.8 p -117.71 -173.91 2.52 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.395 1.078 . . . . 0.0 112.8 -169.634 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 49.4 pttt -41.47 -54.53 3.09 Favored 'General case' 0 C--N 1.34 0.194 0 C-N-CA 126.144 1.778 . . . . 0.0 113.77 -177.821 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.84 -52.83 59.16 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 124.66 1.184 . . . . 0.0 108.457 -177.985 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -64.33 -38.59 91.57 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 123.723 0.809 . . . . 0.0 110.689 -177.441 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.4 HD12 ' CE2' ' A' ' 76' ' ' PHE . 2.7 mm? -60.95 -54.91 39.22 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 118.869 0.758 . . . . 0.0 111.299 175.245 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 53.4 mtmt -56.54 -48.53 77.06 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.067 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 62.9 tt0 -50.46 -59.0 4.45 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.174 0.989 . . . . 0.0 110.427 175.206 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mt -47.1 -65.87 0.5 Allowed 'General case' 0 C--O 1.232 0.165 0 C-N-CA 124.968 1.307 . . . . 0.0 110.411 177.88 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 16.7 tt -62.42 -45.7 98.17 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 C-N-CA 120.04 -0.664 . . . . 0.0 109.77 -170.458 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -58.72 -51.79 68.46 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 122.836 0.454 . . . . 0.0 111.404 -179.268 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -66.26 -57.66 7.06 Favored 'General case' 0 C--N 1.339 0.11 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 -177.517 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -71.96 -61.63 1.72 Allowed 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 -169.837 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 54.7 mt . . . . . 0 N--CA 1.451 -0.382 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.447 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 . . . . . 0 C--O 1.226 -0.14 0 N-CA-C 110.405 -0.22 . . . . 0.0 110.405 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -38.03 -58.18 0.97 Allowed 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.648 1.179 . . . . 0.0 113.548 -171.762 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -64.21 -38.36 90.78 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 122.751 0.42 . . . . 0.0 111.196 -175.071 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.556 ' H ' ' CD1' ' A' ' 53' ' ' ILE . 0.8 OUTLIER -62.13 -54.12 38.61 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 N-CA-C 106.397 -1.705 . . . . 0.0 106.397 179.206 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 87.5 t -57.4 -42.09 79.88 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 C-N-CA 124.173 0.989 . . . . 0.0 110.566 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.05 -50.59 73.13 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 119.384 0.993 . . . . 0.0 110.886 175.13 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 42.1 mt -54.21 -45.19 72.18 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 119.396 -0.335 . . . . 0.0 110.681 177.168 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 23.2 mmt -64.94 -60.69 2.77 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 121.403 0.621 . . . . 0.0 109.499 177.96 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -42.7 -42.93 3.68 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 126.815 2.046 . . . . 0.0 111.521 -178.4 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -45.7 -45.37 14.22 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 118.517 -0.754 . . . . 0.0 112.97 178.19 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . 0.259 0.5 OUTLIER -72.04 -11.49 60.78 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 119.805 1.184 . . . . 0.0 113.209 -176.838 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -90.68 -53.89 4.22 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 118.983 0.81 . . . . 0.0 109.206 169.774 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 55.3 ttm-85 . . . . . 0 CA--C 1.532 0.276 0 C-N-CA 123.986 0.914 . . . . 0.0 110.693 179.552 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.9 mp0 . . . . . 0 N--CA 1.448 -0.56 0 N-CA-C 106.241 -1.763 . . . . 0.0 106.241 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -96.96 151.16 4.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 C-N-CA 124.266 1.026 . . . . 0.0 108.467 172.442 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -92.94 177.12 6.18 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 122.834 0.454 . . . . 0.0 111.287 176.755 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 79.6 t80 -41.14 -62.43 0.84 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.315 1.046 . . . . 0.0 112.034 171.32 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 39.8 tp60 -60.64 -37.42 81.43 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 119.24 0.927 . . . . 0.0 111.623 -174.809 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -61.47 -44.68 96.67 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 119.28 0.946 . . . . 0.0 111.424 173.029 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -53.94 -50.03 67.38 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 118.742 0.701 . . . . 0.0 109.726 172.581 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.401 ' CG2' ' CG2' ' B' ' 74' ' ' ILE . 28.1 mm -57.96 -38.27 65.7 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 O-C-N 121.901 -0.499 . . . . 0.0 110.518 176.024 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 61.3 m -64.88 -42.39 94.85 Favored 'General case' 0 C--O 1.226 -0.134 0 CA-C-N 118.824 0.738 . . . . 0.0 110.234 177.781 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.4 ' CE2' HD12 ' A' ' 34' ' ' LEU . 33.0 t80 -55.55 -52.69 62.88 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.429 0.691 . . . . 0.0 109.213 174.863 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 62.3 mt -60.66 -44.69 96.14 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 177.31 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.13 -44.41 94.12 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 110.623 -0.991 . . . . 0.0 110.623 -176.884 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.85 -52.13 66.74 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.252 0.621 . . . . 0.0 109.824 174.718 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 11.7 tp -47.78 -58.15 4.7 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 122.002 0.906 . . . . 0.0 110.381 175.228 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -49.67 -55.47 13.65 Favored 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 125.43 1.492 . . . . 0.0 109.857 -179.327 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 12.9 ttp -60.53 -44.31 96.19 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 123.364 0.666 . . . . 0.0 111.507 -178.738 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 51.7 mt -59.19 -54.61 31.9 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-O 118.258 -0.877 . . . . 0.0 110.049 -178.36 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.391 0.6 OUTLIER -76.0 -34.22 59.71 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 118.188 -1.405 . . . . 0.0 112.964 -179.08 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 37.0 m-80 -80.33 71.06 7.11 Favored 'General case' 0 N--CA 1.465 0.276 0 O-C-N 120.654 -1.279 . . . . 0.0 108.747 170.843 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -46.55 -31.5 2.82 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.554 1.142 . . . . 0.0 112.798 -178.124 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -42.47 -37.75 1.71 Allowed 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.044 1.338 . . . . 0.0 113.729 173.264 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 88.4 mt . . . . . 0 CA--C 1.534 0.328 0 N-CA-C 112.949 0.722 . . . . 0.0 112.949 -177.61 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.249 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 9.6 m -54.14 160.57 2.31 Favored Pre-proline 0 CA--C 1.538 0.509 0 C-N-CA 123.309 0.643 . . . . 0.0 110.851 175.172 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_exo -42.16 -49.56 5.86 Favored 'Trans proline' 0 N--CA 1.459 -0.52 0 C-N-CA 123.775 2.983 . . . . 0.0 113.661 177.275 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 6.1 mt -54.52 -50.52 67.67 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-N 117.956 0.344 . . . . 0.0 111.54 173.954 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -63.49 -40.9 98.31 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 118.211 0.459 . . . . 0.0 110.196 -175.126 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 tp60 -61.89 -47.07 86.64 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 122.142 0.177 . . . . 0.0 110.694 174.907 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.05 -46.88 85.45 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.465 0.706 . . . . 0.0 111.02 -178.428 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 62.1 mt -51.4 -54.4 11.91 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 N-CA-C 107.948 -1.131 . . . . 0.0 107.948 169.687 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.07 -46.88 20.57 Favored Glycine 0 CA--C 1.528 0.859 0 C-N-CA 124.906 1.241 . . . . 0.0 112.183 175.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.2 mt -57.38 -54.21 49.37 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 117.59 0.695 . . . . 0.0 111.055 174.489 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -58.52 -44.07 89.37 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 118.863 0.756 . . . . 0.0 111.481 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 72.2 mt -54.38 -55.73 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 C-N-CA 123.462 0.705 . . . . 0.0 110.077 172.496 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.28 -51.38 51.36 Favored Glycine 0 CA--C 1.524 0.633 0 N-CA-C 110.234 -1.146 . . . . 0.0 110.234 -176.781 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 14.1 mm -54.5 -45.83 70.84 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 C-N-CA 122.79 0.436 . . . . 0.0 110.499 175.892 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -57.12 -60.19 3.98 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 118.465 0.575 . . . . 0.0 109.997 176.861 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -55.34 -36.46 66.31 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 124.424 1.09 . . . . 0.0 111.511 -174.181 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -52.59 -31.06 34.4 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.566 1.146 . . . . 0.0 112.257 176.714 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -112.59 -34.08 5.94 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.764 0.711 . . . . 0.0 112.076 -179.315 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 77.8 p . . . . . 0 N--CA 1.455 -0.182 0 CA-C-N 119.135 0.88 . . . . 0.0 110.866 179.582 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 . . . . . 0 CA--C 1.537 0.457 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 22.9 p -129.87 164.25 24.56 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 124.836 1.255 . . . . 0.0 111.419 -177.755 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -159.56 169.07 24.62 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.626 1.17 . . . . 0.0 109.364 169.716 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 78.5 p -115.94 174.16 6.18 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 -169.382 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 38.1 mtmm -26.35 -60.3 0.08 Allowed 'General case' 0 C--N 1.34 0.171 0 C-N-CA 127.764 2.426 . . . . 0.0 112.597 169.7 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 28.8 ttpp -53.37 -53.23 54.18 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.885 0.874 . . . . 0.0 110.748 -177.091 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -61.36 -40.44 94.31 Favored 'General case' 0 C--O 1.222 -0.344 0 CA-C-O 118.967 -0.54 . . . . 0.0 110.595 179.293 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 31.1 mt -64.49 -48.05 76.65 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.934 0.788 . . . . 0.0 111.179 -179.52 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -58.12 -47.93 81.77 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 176.028 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.63 -51.14 69.85 Favored 'General case' 0 C--O 1.225 -0.216 0 CA-C-N 117.762 0.255 . . . . 0.0 111.242 174.976 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 11.5 mt -48.18 -57.51 5.8 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 124.25 1.02 . . . . 0.0 109.77 179.07 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 1.3 mp -56.84 -59.1 3.42 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 C-N-CA 120.18 -0.608 . . . . 0.0 109.831 175.179 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -51.33 -46.8 62.75 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.358 0.663 . . . . 0.0 112.372 -171.183 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.71 -64.54 1.16 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.709 0.804 . . . . 0.0 110.08 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -73.87 -24.84 59.8 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -167.177 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 96.3 mt . . . . . 0 C--N 1.333 -0.12 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 169.287 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 21.0 t70 . . . . . 0 N--CA 1.462 0.172 0 N-CA-C 111.927 0.343 . . . . 0.0 111.927 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -34.77 -60.99 0.42 Allowed 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.905 1.282 . . . . 0.0 113.72 -176.614 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -66.23 -33.97 76.96 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.588 0.355 . . . . 0.0 111.365 -174.469 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 53' ' ' ILE . . . . . 0.463 ' H ' ' CD1' ' B' ' 53' ' ' ILE . 1.0 OUTLIER -62.89 -55.73 21.87 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 178.665 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 55.8 t -57.66 -43.82 84.3 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 CA-C-O 118.755 -0.64 . . . . 0.0 110.599 179.6 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.48 -51.06 69.87 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 119.233 0.924 . . . . 0.0 110.562 176.492 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 55.2 mt -56.63 -40.58 75.63 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 119.058 -0.496 . . . . 0.0 111.405 178.751 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 28.3 mmt -67.25 -65.04 0.74 Allowed 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.919 0.781 . . . . 0.0 109.453 175.531 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -40.58 -41.93 1.57 Allowed 'General case' 0 CA--C 1.521 -0.155 0 C-N-CA 128.022 2.529 . . . . 0.0 111.939 -177.693 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -37.73 -49.17 1.13 Allowed 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 124.93 1.292 . . . . 0.0 112.287 176.904 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.6 pp -61.18 -42.91 99.41 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 120.958 -0.297 . . . . 0.0 111.085 -176.613 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -73.98 -38.3 64.19 Favored 'General case' 0 C--O 1.226 -0.173 0 C-N-CA 123.155 0.582 . . . . 0.0 110.407 -179.175 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 15.8 ttm180 -59.46 -47.98 83.39 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.164 0.586 . . . . 0.0 109.951 177.788 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 . . . . . 0 N--CA 1.457 -0.094 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.264 -175.52 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 40.6 mp0 . . . . . 0 N--CA 1.451 -0.388 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 11.7 m -80.07 145.25 9.46 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 171.478 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -82.89 172.21 13.06 Favored 'General case' 0 CA--C 1.528 0.107 0 CA-C-N 117.961 0.346 . . . . 0.0 111.193 176.282 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -40.86 -61.61 0.94 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.185 0.994 . . . . 0.0 112.146 172.161 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 38.2 tp60 -60.33 -37.04 79.36 Favored 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.224 -0.922 . . . . 0.0 111.795 -175.692 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -64.93 -40.82 95.62 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 121.284 -0.885 . . . . 0.0 111.488 174.959 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -56.43 -49.72 73.74 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.571 -0.706 . . . . 0.0 109.622 170.535 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 0.401 ' CG2' ' CG2' ' A' ' 74' ' ' ILE . 29.0 mm -56.24 -39.56 60.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 175.884 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 43.1 m -65.69 -35.74 81.63 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 118.59 0.632 . . . . 0.0 110.679 176.932 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 13.1 t80 -56.02 -56.25 23.06 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 171.955 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 67.7 mt -61.25 -40.13 92.91 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 179.089 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -69.05 -45.6 61.92 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 110.675 -0.97 . . . . 0.0 110.675 -176.134 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.29 -43.82 89.92 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 122.112 -0.64 . . . . 0.0 110.058 175.895 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 12.0 tp -50.56 -57.58 7.82 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-O 121.371 0.605 . . . . 0.0 109.939 172.55 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.19 -50.86 48.04 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 124.441 1.096 . . . . 0.0 110.527 176.911 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 49.2 ttm -58.33 -47.75 82.74 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.715 0.806 . . . . 0.0 111.135 -178.561 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 93.9 mt -64.65 -52.72 51.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 CA-C-O 118.135 -0.936 . . . . 0.0 110.398 -176.789 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.449 0.1 OUTLIER -76.2 -38.86 55.96 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 118.521 -1.271 . . . . 0.0 113.3 -176.672 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -82.13 66.99 7.96 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 169.87 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -39.44 -37.8 0.5 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.818 1.647 . . . . 0.0 113.842 -175.188 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.99 -53.98 0.47 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.004 1.722 . . . . 0.0 112.502 169.719 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 93.2 mt . . . . . 0 C--O 1.224 -0.267 0 C-N-CA 123.81 0.844 . . . . 0.0 113.081 -174.039 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.257 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.1 m -55.56 163.09 2.04 Favored Pre-proline 0 CA--C 1.537 0.452 0 C-N-CA 124.102 0.961 . . . . 0.0 110.846 178.622 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -43.85 -49.02 8.57 Favored 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 123.62 2.88 . . . . 0.0 113.409 179.616 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.2 mt -55.14 -52.13 64.25 Favored 'General case' 0 C--O 1.225 -0.218 0 O-C-N 122.369 -0.207 . . . . 0.0 111.512 174.346 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -61.56 -41.98 98.18 Favored 'General case' 0 C--O 1.226 -0.181 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 -175.949 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 12.6 tp-100 -60.31 -51.25 70.33 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 123.4 0.68 . . . . 0.0 110.203 177.157 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.14 -46.15 88.58 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.291 0.636 . . . . 0.0 111.442 -177.921 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 56.4 mt -53.07 -51.43 38.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 170.4 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -48.61 -48.03 29.18 Favored Glycine 0 CA--C 1.525 0.688 0 C-N-CA 125.14 1.352 . . . . 0.0 111.587 175.649 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 mt -56.54 -54.03 50.6 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 117.652 0.726 . . . . 0.0 111.055 174.258 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 mp -58.81 -43.71 90.64 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 119.032 0.833 . . . . 0.0 111.453 -179.404 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 94.2 mt -56.52 -51.66 62.58 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 C-N-CA 123.632 0.773 . . . . 0.0 110.36 172.641 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.23 -51.58 53.19 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.046 -1.222 . . . . 0.0 110.046 -178.224 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 10.4 mm -57.01 -46.29 84.08 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 123.158 0.583 . . . . 0.0 110.284 176.893 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 40.6 t80 -53.2 -59.16 4.9 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 121.211 0.529 . . . . 0.0 109.965 176.754 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 67.4 t60 -62.09 -33.75 75.02 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.706 -175.682 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -51.96 -45.61 64.46 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.69 0.677 . . . . 0.0 110.963 176.38 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -89.86 -49.55 6.56 Favored 'General case' 0 N--CA 1.46 0.037 0 CA-C-O 118.932 -0.556 . . . . 0.0 110.946 -178.67 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 74.8 m . . . . . 0 C--O 1.224 -0.248 0 CA-C-N 119.166 0.894 . . . . 0.0 111.384 174.652 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.228 0 N-CA-C 103.192 -2.892 . . . . 0.0 103.192 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -160.74 168.04 25.62 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 120.158 1.345 . . . . 0.0 112.253 177.555 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 24.7 p -113.19 176.46 5.01 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.617 0.723 . . . . 0.0 112.503 -173.42 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 20.7 pttm -40.62 -46.94 2.66 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 126.051 1.74 . . . . 0.0 112.846 174.802 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.0 tmmt? -59.08 -49.7 76.89 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -178.083 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 27.2 mp0 -62.98 -38.62 91.88 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 118.756 -0.64 . . . . 0.0 110.963 177.684 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 26.1 mt -62.43 -45.01 95.05 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 119.319 0.963 . . . . 0.0 111.182 178.418 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -58.3 -49.47 77.03 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 122.025 -0.422 . . . . 0.0 109.978 173.203 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 57.6 mt-10 -56.47 -43.82 79.97 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 118.03 0.377 . . . . 0.0 111.449 175.924 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.0 mt -54.32 -56.3 19.84 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 119.296 0.953 . . . . 0.0 109.492 -178.432 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 1.3 mp -55.96 -60.7 1.55 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 175.409 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.8 tt0 -52.31 -51.42 58.74 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.649 0.78 . . . . 0.0 112.383 -171.703 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.1 mmpt? -73.4 -61.12 1.94 Allowed 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.987 1.315 . . . . 0.0 109.307 -175.343 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 60.5 mm-40 -76.71 -58.01 3.53 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -169.896 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 85.1 mt . . . . . 0 N--CA 1.454 -0.264 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 178.868 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 . . . . . 0 N--CA 1.462 0.153 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.46 -58.27 0.16 Allowed 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 126.08 1.752 . . . . 0.0 113.839 -177.408 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -70.08 -35.88 74.51 Favored 'General case' 0 CA--C 1.53 0.191 0 O-C-N 122.258 -0.276 . . . . 0.0 111.466 -173.23 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.491 HD12 ' H ' ' A' ' 53' ' ' ILE . 1.2 mp -62.72 -54.71 30.27 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 177.064 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 72.5 t -54.21 -44.45 64.67 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 C-N-CA 124.458 1.103 . . . . 0.0 110.034 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 2.9 mptp? -57.52 -53.17 61.23 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 118.283 0.492 . . . . 0.0 110.793 175.337 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 71.2 mt -54.83 -37.81 66.61 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 118.965 -0.54 . . . . 0.0 111.198 178.95 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 27.8 mmt -66.95 -67.61 0.44 Allowed 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 118.809 0.732 . . . . 0.0 109.525 173.79 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -40.48 -42.62 1.66 Allowed 'General case' 0 C--N 1.341 0.199 0 C-N-CA 127.527 2.331 . . . . 0.0 111.95 -176.563 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -38.7 -49.64 1.59 Allowed 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 125.261 1.424 . . . . 0.0 112.492 177.095 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -63.24 -42.0 99.14 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 121.032 -0.267 . . . . 0.0 110.715 -176.87 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -69.52 -42.17 75.04 Favored 'General case' 0 N--CA 1.457 -0.084 0 C-N-CA 123.538 0.735 . . . . 0.0 109.602 -178.772 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 17.5 ttm180 . . . . . 0 N--CA 1.451 -0.405 0 C-N-CA 124.25 1.02 . . . . 0.0 110.143 178.647 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 22.5 mp0 . . . . . 0 CA--C 1.534 0.331 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 25.8 m -115.05 149.11 17.36 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.558 0 C-N-CA 125.917 1.687 . . . . 0.0 107.758 169.889 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -85.8 175.57 8.6 Favored 'General case' 0 C--N 1.338 0.102 0 C-N-CA 123.68 0.792 . . . . 0.0 111.015 177.454 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -41.91 -63.8 0.68 Allowed 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.806 1.242 . . . . 0.0 112.436 175.989 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 9.9 tp-100 -64.5 -30.45 71.48 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 120.339 1.427 . . . . 0.0 112.019 -173.276 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -66.84 -45.53 77.94 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 119.35 0.977 . . . . 0.0 110.348 175.17 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -54.72 -52.27 62.99 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 172.714 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 22.8 mm -55.32 -41.41 61.58 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.411 0 C-N-CA 123.102 0.561 . . . . 0.0 109.519 176.88 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 99.4 m -62.39 -36.04 81.08 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-N 119.089 0.859 . . . . 0.0 111.062 177.088 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -54.89 -54.57 40.8 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 118.887 0.767 . . . . 0.0 109.185 171.35 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 62.3 mt -63.63 -40.86 97.97 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 -179.506 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -72.83 -44.29 38.58 Favored Glycine 0 CA--C 1.522 0.522 0 N-CA-C 110.128 -1.189 . . . . 0.0 110.128 -174.365 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.43 -45.11 92.44 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 121.949 -0.736 . . . . 0.0 109.795 173.255 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 12.4 tp -49.81 -58.14 5.96 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 118.802 0.728 . . . . 0.0 109.909 173.133 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -49.34 -54.03 19.19 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 124.804 1.242 . . . . 0.0 110.606 178.95 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 25.4 ttp -64.11 -41.54 97.21 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.252 0.621 . . . . 0.0 112.068 -176.443 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 80.0 mt -65.12 -51.56 64.29 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 CA-C-O 118.042 -0.98 . . . . 0.0 109.746 -178.879 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.46 0.1 OUTLIER -75.76 -39.3 57.34 Favored 'General case' 0 C--N 1.346 0.436 0 CA-C-N 119.713 1.142 . . . . 0.0 113.283 -178.544 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 -81.07 65.01 6.05 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 168.861 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -47.91 -32.86 6.8 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.94 1.296 . . . . 0.0 112.4 -169.903 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -32.54 -50.55 0.25 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 126.104 1.762 . . . . 0.0 112.773 168.355 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 63.2 mt . . . . . 0 CA--C 1.53 0.21 0 C-N-CA 124.015 0.926 . . . . 0.0 113.322 -174.864 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.242 0 CA-C-O 121.191 0.519 . . . . 0.0 110.053 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 4.2 m -58.1 165.17 2.84 Favored Pre-proline 0 CA--C 1.538 0.513 0 C-N-CA 124.961 1.305 . . . . 0.0 111.365 179.193 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -44.47 -46.77 11.71 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 123.503 2.802 . . . . 0.0 113.306 177.834 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.426 HD23 ' HA ' ' B' ' 5' ' ' LEU . 5.7 mt -56.16 -51.48 67.82 Favored 'General case' 0 C--O 1.225 -0.229 0 CA-C-N 117.844 0.293 . . . . 0.0 111.577 174.123 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -57.83 -45.57 85.97 Favored 'General case' 0 N--CA 1.456 -0.159 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 -177.782 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -58.73 -51.57 69.41 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 122.932 0.493 . . . . 0.0 110.727 177.38 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.32 -45.41 88.0 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.719 0.807 . . . . 0.0 111.668 -176.158 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 78.7 mt -54.13 -52.38 38.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 170.475 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.15 -48.36 15.08 Favored Glycine 0 CA--C 1.528 0.855 0 C-N-CA 124.867 1.222 . . . . 0.0 111.946 174.539 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.3 mt -56.88 -55.85 29.15 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 117.649 0.725 . . . . 0.0 111.27 174.407 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -58.69 -42.38 88.42 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.172 0.897 . . . . 0.0 111.711 -178.445 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 78.7 mt -54.63 -58.97 2.64 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.135 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 171.442 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -52.29 -48.03 54.69 Favored Glycine 0 CA--C 1.524 0.604 0 C-N-CA 124.726 1.155 . . . . 0.0 111.214 -175.852 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 12.5 mm -54.63 -46.58 72.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 C-N-CA 123.105 0.562 . . . . 0.0 110.386 176.395 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 26.2 t80 -61.05 -54.27 46.88 Favored 'General case' 0 CA--C 1.531 0.241 0 O-C-N 121.708 -0.62 . . . . 0.0 109.818 176.1 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -50.74 -41.72 56.81 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 125.308 1.443 . . . . 0.0 111.435 -176.863 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -55.58 -34.01 64.41 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.934 1.293 . . . . 0.0 112.407 179.312 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 47.1 m-85 -109.06 -57.45 2.15 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 123.587 0.755 . . . . 0.0 110.896 -176.429 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.454 -0.237 0 C-N-CA 123.504 0.722 . . . . 0.0 110.244 -177.983 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 21.9 t-160 . . . . . 0 CA--C 1.535 0.387 0 N-CA-C 111.552 0.204 . . . . 0.0 111.552 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 1.1 p -130.57 158.68 39.33 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 125.107 1.363 . . . . 0.0 112.606 -168.452 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.94 -179.79 7.84 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.055 1.342 . . . . 0.0 108.553 169.423 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 7.3 t -141.6 -163.21 1.52 Allowed 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 119.355 0.98 . . . . 0.0 112.673 -178.127 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 8.6 mtpm? -36.79 -69.12 0.12 Allowed 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 128.716 2.806 . . . . 0.0 113.662 -169.189 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -55.38 -46.97 76.5 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 122.772 0.429 . . . . 0.0 110.068 -173.625 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -61.32 -44.12 97.74 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 123.797 0.839 . . . . 0.0 110.712 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 51.7 mt -61.31 -52.98 62.43 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 118.341 0.519 . . . . 0.0 111.015 177.072 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 47.9 mtpt -60.92 -42.61 98.46 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -177.786 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 66.4 mt-10 -54.61 -55.58 28.02 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-O 118.962 -0.542 . . . . 0.0 110.904 169.839 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 9.1 mt -47.36 -58.89 3.63 Favored 'General case' 0 N--CA 1.457 -0.103 0 C-N-CA 123.406 0.682 . . . . 0.0 110.193 -178.482 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 13.3 tt -59.34 -55.18 25.39 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 C-N-CA 119.766 -0.774 . . . . 0.0 110.54 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -58.41 -46.05 87.18 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 118.435 0.562 . . . . 0.0 112.438 -172.7 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -76.76 -51.08 12.07 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.509 0.724 . . . . 0.0 110.093 -177.263 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -83.54 -28.7 28.43 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -168.247 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 32.7 mt . . . . . 0 C--N 1.338 0.069 0 N-CA-C 106.412 -1.699 . . . . 0.0 106.412 168.483 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 . . . . . 0 C--O 1.227 -0.113 0 N-CA-C 114.397 1.258 . . . . 0.0 114.397 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.58 -61.57 0.14 Allowed 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 125.594 1.558 . . . . 0.0 114.146 -175.217 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -60.31 -43.15 96.62 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.298 0.639 . . . . 0.0 111.333 -175.812 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 53' ' ' ILE . . . . . 0.526 ' H ' ' CD1' ' B' ' 53' ' ' ILE . 1.0 OUTLIER -62.16 -51.99 65.79 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 N-CA-C 106.066 -1.827 . . . . 0.0 106.066 -178.785 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 70.7 t -55.3 -40.02 54.74 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.613 0 CA-C-N 114.891 -1.05 . . . . 0.0 110.239 178.378 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.84 -52.81 63.48 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 120.214 1.37 . . . . 0.0 110.517 174.741 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 57.1 mt -53.52 -39.57 64.74 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 119.573 -0.251 . . . . 0.0 110.683 -178.971 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 22.9 mmt -71.12 -64.23 0.95 Allowed 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.424 0.63 . . . . 0.0 110.003 175.54 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.01 -29.4 60.29 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 125.041 1.336 . . . . 0.0 112.212 -169.718 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -39.52 -50.69 2.19 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 124.632 1.173 . . . . 0.0 111.037 170.584 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 54.1 mt -58.82 -47.08 86.07 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.125 -176.421 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -69.73 -46.43 65.93 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.439 0.696 . . . . 0.0 111.283 -178.128 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 50.9 ttt85 -56.84 -52.22 65.94 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 124.972 1.309 . . . . 0.0 109.414 -179.774 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 20.3 m120 . . . . . 0 N--CA 1.452 -0.371 0 CA-C-N 116.625 -0.261 . . . . 0.0 111.556 -176.121 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 . . . . . 0 N--CA 1.45 -0.433 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 20.9 m -99.89 146.49 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 169.837 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -85.36 176.02 8.54 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 123.418 0.687 . . . . 0.0 111.271 175.885 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -40.65 -63.82 0.6 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.306 1.043 . . . . 0.0 112.533 172.421 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 61.6 tp60 -61.03 -36.21 78.92 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 119.755 1.161 . . . . 0.0 111.671 -175.425 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -64.37 -35.84 82.18 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.255 -0.903 . . . . 0.0 111.081 175.621 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -62.97 -46.8 86.02 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.507 -0.746 . . . . 0.0 109.626 169.361 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 24.2 mm -60.63 -29.19 44.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 O-C-N 121.49 -0.756 . . . . 0.0 110.513 176.187 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 25.3 m -67.2 -45.13 77.8 Favored 'General case' 0 C--O 1.227 -0.1 0 O-C-N 121.232 -0.917 . . . . 0.0 109.411 171.943 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -52.32 -54.99 24.51 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 173.676 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 38.8 mt -59.44 -46.36 88.98 Favored 'General case' 0 CA--C 1.529 0.168 0 O-C-N 121.727 -0.608 . . . . 0.0 111.691 177.86 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.57 -45.68 92.91 Favored Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 -179.261 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.97 -51.74 65.71 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 123.493 0.717 . . . . 0.0 110.023 177.281 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -47.36 -58.68 3.87 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.95 0.881 . . . . 0.0 110.272 174.943 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.08 -56.61 11.73 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 125.18 1.392 . . . . 0.0 110.643 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 12.8 ttp -67.05 -39.15 86.84 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.607 0.763 . . . . 0.0 111.806 -174.372 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 64.5 mt -63.74 -51.76 65.75 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 CA-C-O 117.807 -1.092 . . . . 0.0 109.195 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.474 0.3 OUTLIER -75.25 -38.15 60.67 Favored 'General case' 0 C--N 1.348 0.5 0 CA-C-N 119.897 1.226 . . . . 0.0 113.319 -179.867 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 -80.57 61.88 4.44 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 168.872 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -52.26 -25.01 8.31 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.532 1.133 . . . . 0.0 112.55 -175.818 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -38.6 -46.72 1.23 Allowed 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.164 1.385 . . . . 0.0 111.845 167.366 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 84.4 mt . . . . . 0 CA--C 1.532 0.252 0 C-N-CA 124.12 0.968 . . . . 0.0 113.041 -178.218 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.222 0 CA-C-O 121.252 0.548 . . . . 0.0 111.431 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 78.7 p -60.69 167.4 3.4 Favored Pre-proline 0 CA--C 1.536 0.418 0 C-N-CA 124.414 1.086 . . . . 0.0 112.2 175.479 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -50.57 -44.3 40.84 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 122.619 2.213 . . . . 0.0 111.215 168.245 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.415 HD23 ' HA ' ' A' ' 5' ' ' LEU . 4.8 mt -53.65 -57.49 10.61 Favored 'General case' 0 C--N 1.342 0.252 0 CA-C-O 119.448 -0.31 . . . . 0.0 111.671 170.871 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -52.57 -47.65 66.68 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 120.848 0.356 . . . . 0.0 110.356 -177.757 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 -59.39 -49.41 77.92 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.921 0.888 . . . . 0.0 110.919 178.351 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.77 -46.63 88.74 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.866 0.866 . . . . 0.0 111.132 -178.084 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 83.1 mt -54.67 -51.41 51.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 172.057 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.72 -50.35 14.78 Favored Glycine 0 CA--C 1.53 0.991 0 C-N-CA 124.562 1.077 . . . . 0.0 111.963 173.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 mt -54.65 -54.37 42.52 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 117.721 0.761 . . . . 0.0 110.936 175.297 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 9.8 mp -58.71 -43.68 90.17 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 118.79 0.723 . . . . 0.0 111.687 -178.975 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 97.3 mt -58.59 -52.18 62.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 C-N-CA 123.22 0.608 . . . . 0.0 110.433 174.789 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.96 -54.55 34.51 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 109.942 -1.263 . . . . 0.0 109.942 -178.325 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 6.0 mm -50.01 -50.11 20.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.25 0 C-N-CA 123.843 0.857 . . . . 0.0 109.911 174.989 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -52.89 -62.71 1.47 Allowed 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 179.058 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -63.38 -23.57 67.47 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 -175.408 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.8 ttpp -53.94 -24.69 17.28 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 118.782 0.719 . . . . 0.0 111.97 170.502 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -116.95 -37.34 3.61 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.044 0.938 . . . . 0.0 112.792 175.71 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 75.5 p . . . . . 0 CA--C 1.528 0.125 0 CA-C-N 119.515 1.052 . . . . 0.0 112.164 -178.169 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 74.6 p . . . . . 0 CA--C 1.528 0.097 0 CA-C-O 121.069 0.461 . . . . 0.0 111.318 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -159.69 -165.04 1.44 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.211 1.404 . . . . 0.0 107.44 169.498 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 9.2 m -156.88 -179.5 8.26 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 119.371 0.987 . . . . 0.0 111.633 -171.753 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -19.72 -72.98 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 129.247 3.019 . . . . 0.0 114.429 176.78 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 39.8 ttpt -53.42 -52.16 60.27 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.515 1.126 . . . . 0.0 109.785 -175.384 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -58.86 -42.84 90.33 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 118.725 -0.655 . . . . 0.0 111.124 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 13.4 mt -61.55 -50.03 74.3 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 119.141 0.882 . . . . 0.0 111.459 176.486 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 62.0 mtpt -58.55 -46.41 86.92 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 122.191 -0.318 . . . . 0.0 110.221 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.81 -51.88 67.24 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 122.856 0.463 . . . . 0.0 110.998 173.773 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.0 mt -46.53 -61.1 1.97 Allowed 'General case' 0 C--N 1.333 -0.151 0 C-N-CA 123.747 0.819 . . . . 0.0 110.561 177.541 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 16.8 tt -59.41 -52.24 63.23 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 C-N-CA 119.829 -0.748 . . . . 0.0 110.157 -178.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -53.99 -50.35 66.79 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 123.604 0.761 . . . . 0.0 112.456 -175.664 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.06 -53.04 7.86 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 123.629 0.771 . . . . 0.0 110.266 -176.77 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 49.2 mm-40 -81.16 -24.38 37.6 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -167.597 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 47.4 mt . . . . . 0 CA--C 1.527 0.074 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 169.446 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 22.6 t70 . . . . . 0 C--O 1.227 -0.108 0 N-CA-C 110.194 -0.298 . . . . 0.0 110.194 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -36.4 -62.98 0.42 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.966 1.306 . . . . 0.0 113.415 -175.857 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 73.1 tt0 -59.35 -43.05 92.86 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.85 0.86 . . . . 0.0 111.004 -178.605 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.488 ' H ' ' CD1' ' A' ' 53' ' ' ILE . 0.9 OUTLIER -60.89 -53.72 45.24 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 N-CA-C 106.49 -1.67 . . . . 0.0 106.49 -173.834 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 66.6 t -56.01 -58.68 4.24 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 CA-C-O 118.154 -0.927 . . . . 0.0 108.647 176.256 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -41.22 -51.52 3.51 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 119.038 0.835 . . . . 0.0 112.403 -178.738 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 27.0 mt -55.92 -43.78 77.66 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -176.588 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 1.4 mpp? -82.07 -58.34 3.01 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.958 0.903 . . . . 0.0 109.997 -179.585 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -42.78 -31.29 0.46 Allowed 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 126.671 1.988 . . . . 0.0 111.954 176.364 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -37.2 -43.44 0.51 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.587 1.155 . . . . 0.0 113.261 172.555 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -58.02 -57.58 12.2 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.51 -0.744 . . . . 0.0 110.115 177.789 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -58.61 -45.41 89.25 Favored 'General case' 0 C--O 1.224 -0.289 0 C-N-CA 124.381 1.073 . . . . 0.0 110.361 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 43.0 tpt85 . . . . . 0 N--CA 1.451 -0.396 0 C-N-CA 126.074 1.75 . . . . 0.0 110.785 177.399 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 . . . . . 0 CA--C 1.533 0.309 0 CA-C-O 120.49 0.186 . . . . 0.0 110.657 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -122.35 143.69 34.21 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 C-N-CA 124.898 1.279 . . . . 0.0 108.647 175.246 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 17.4 p30 -92.77 -177.59 4.59 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 125.162 1.385 . . . . 0.0 111.589 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 49.4 t80 -47.37 -60.63 2.38 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.677 0.791 . . . . 0.0 112.769 175.696 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 47.8 tp60 -63.17 -34.63 78.05 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 119.489 1.041 . . . . 0.0 110.579 -175.521 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 72.2 mm-40 -58.26 -49.86 75.61 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.943 -0.473 . . . . 0.0 110.498 173.803 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -55.15 -50.02 70.35 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 122.947 0.499 . . . . 0.0 110.512 173.917 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 26.3 mm -57.26 -34.3 45.52 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 C-N-CA 123.207 0.603 . . . . 0.0 110.534 177.372 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 61.1 m -71.13 -39.29 72.09 Favored 'General case' 0 CA--C 1.531 0.227 0 O-C-N 121.568 -0.708 . . . . 0.0 110.684 176.061 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -57.17 -53.75 54.62 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 118.902 0.774 . . . . 0.0 109.959 173.26 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 53.6 mt -58.57 -42.35 87.77 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.804 0.335 . . . . 0.0 110.854 174.928 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.42 -46.05 88.09 Favored Glycine 0 CA--C 1.524 0.608 0 C-N-CA 124.244 0.926 . . . . 0.0 111.083 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.3 -49.28 74.63 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.362 0.665 . . . . 0.0 110.001 177.11 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -49.49 -59.63 3.58 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 122.472 1.13 . . . . 0.0 109.879 176.466 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -49.01 -59.75 3.35 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 113.663 -1.608 . . . . 0.0 110.254 178.597 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 22.7 ttp -63.87 -40.27 96.15 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.199 0.6 . . . . 0.0 112.004 -173.644 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 70.0 mt -62.94 -48.94 85.63 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 CA-C-O 117.77 -1.11 . . . . 0.0 109.679 -179.405 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.43 1.2 p90 -79.02 -33.54 44.75 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 117.812 -1.555 . . . . 0.0 113.975 179.117 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 32.1 m-80 -79.98 89.01 5.32 Favored 'General case' 0 C--N 1.334 -0.066 0 O-C-N 121.019 -1.051 . . . . 0.0 109.66 175.698 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -42.04 -42.32 2.84 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.573 0.749 . . . . 0.0 111.082 169.705 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.23 16.77 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 114.854 1.428 . . . . 0.0 114.854 178.899 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 46.9 mt . . . . . 0 CA--C 1.53 0.195 0 C-N-CA 125.136 1.374 . . . . 0.0 112.533 170.292 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.274 0 CA-C-O 121.011 0.434 . . . . 0.0 111.581 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.4 m -58.9 167.47 1.92 Allowed Pre-proline 0 CA--C 1.539 0.53 0 C-N-CA 124.688 1.195 . . . . 0.0 111.404 175.525 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_exo -48.27 -47.57 19.41 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 123.234 2.623 . . . . 0.0 112.988 178.091 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.2 mt -57.11 -49.74 74.95 Favored 'General case' 0 C--O 1.224 -0.278 0 C-N-CA 120.672 -0.411 . . . . 0.0 111.391 173.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -59.12 -40.43 85.38 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-N 118.614 0.643 . . . . 0.0 110.276 -177.77 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -63.02 -52.3 63.42 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.405 0.682 . . . . 0.0 110.703 176.859 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.47 -46.3 89.11 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.599 0.76 . . . . 0.0 111.322 -177.788 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 74.2 mt -52.88 -57.45 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 169.851 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -43.56 -46.41 7.13 Favored Glycine 0 CA--C 1.527 0.819 0 C-N-CA 125.925 1.726 . . . . 0.0 112.456 177.408 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 mt -54.7 -57.12 12.76 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.681 0.792 . . . . 0.0 110.774 172.742 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 11.0 mp -57.62 -42.02 82.47 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.52 -0.737 . . . . 0.0 111.976 178.599 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 18.6 mt -57.36 -56.42 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 C-N-CA 123.828 0.851 . . . . 0.0 110.08 175.326 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.92 -49.79 60.98 Favored Glycine 0 CA--C 1.52 0.404 0 N-CA-C 109.723 -1.351 . . . . 0.0 109.723 -177.863 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.8 mm -53.84 -46.86 63.99 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 C-N-CA 122.734 0.413 . . . . 0.0 110.558 175.731 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 16' ' ' PHE . . . . . 0.408 ' HB2' ' CE2' ' B' ' 73' ' ' TYR . 42.3 t80 -56.61 -64.2 0.95 Allowed 'General case' 0 N--CA 1.457 -0.114 0 CA-C-N 118.529 0.604 . . . . 0.0 110.004 175.933 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -58.28 -34.96 71.09 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 119.351 -0.356 . . . . 0.0 111.313 -169.774 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 64.8 tttm -50.48 -36.61 34.46 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.7 0.8 . . . . 0.0 112.177 175.514 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 77.3 m-85 -104.29 -41.95 5.63 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.186 0.595 . . . . 0.0 111.4 -178.404 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 96.5 p . . . . . 0 CA--C 1.531 0.221 0 O-C-N 121.556 -0.715 . . . . 0.0 111.349 -177.307 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 16.3 m170 . . . . . 0 CA--C 1.536 0.429 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 51.7 p -141.73 162.04 36.45 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.104 0.961 . . . . 0.0 110.036 177.935 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -161.21 179.8 8.07 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 118.045 -0.979 . . . . 0.0 108.92 172.329 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.3 t -137.93 -168.04 2.27 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 120.421 1.464 . . . . 0.0 112.254 -178.375 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 14.9 pttp -45.69 -51.41 12.45 Favored 'General case' 0 C--N 1.337 0.06 0 C-N-CA 126.318 1.847 . . . . 0.0 112.969 -169.873 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -53.34 -49.88 66.17 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 122.99 0.516 . . . . 0.0 110.346 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 19.1 mp0 -68.06 -37.12 80.93 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 119.272 -0.394 . . . . 0.0 110.419 -178.89 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 43.7 mt -62.91 -45.94 90.14 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 118.928 0.786 . . . . 0.0 110.93 177.18 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -57.57 -50.87 71.69 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 173.064 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 59.4 tt0 -51.42 -53.29 38.28 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.056 0.942 . . . . 0.0 110.594 178.283 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 12.8 mt -52.22 -65.08 0.62 Allowed 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 125.839 1.656 . . . . 0.0 109.82 177.108 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 14.3 tt -59.4 -45.51 93.44 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 120.037 -0.665 . . . . 0.0 109.934 -173.067 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 20.3 tt0 -51.16 -59.39 4.24 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.681 0.792 . . . . 0.0 111.551 177.938 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 9.1 mttm -78.33 -53.6 7.11 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-O 121.388 0.613 . . . . 0.0 110.815 -173.234 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 68.0 mm-40 -77.14 -21.45 54.12 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 118.278 -0.868 . . . . 0.0 112.924 -169.703 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 11.1 mt . . . . . 0 N--CA 1.461 0.095 0 CA-C-N 120.263 1.392 . . . . 0.0 108.948 170.185 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 . . . . . 0 CA--C 1.53 0.174 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.34 -56.31 0.15 Allowed 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 126.1 1.76 . . . . 0.0 114.479 -179.131 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 62.6 tt0 -63.8 -44.61 92.79 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 121.257 0.551 . . . . 0.0 110.9 -175.906 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 53' ' ' ILE . . . . . 0.584 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.5 mp -61.25 -52.5 60.68 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 179.855 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 73.4 t -56.29 -44.55 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 C-N-CA 124.249 1.02 . . . . 0.0 110.231 -179.523 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -53.92 -55.13 29.74 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 119.194 0.906 . . . . 0.0 110.497 173.013 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 46.4 mt -53.78 -42.87 68.75 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 119.18 -0.438 . . . . 0.0 111.524 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 24.5 mmt -68.45 -61.79 1.68 Allowed 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.765 0.793 . . . . 0.0 109.832 178.22 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -43.89 -43.52 6.45 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 127.085 2.154 . . . . 0.0 111.199 -177.388 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -39.13 -49.07 1.79 Allowed 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.831 1.253 . . . . 0.0 112.42 178.229 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -60.03 -56.35 22.71 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.28 0.491 . . . . 0.0 109.89 -177.649 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -61.79 -35.5 78.36 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 124.291 1.037 . . . . 0.0 111.482 -177.898 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 10.9 ttp180 -67.11 -52.24 44.28 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 123.759 0.824 . . . . 0.0 109.611 179.015 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 . . . . . 0 CA--C 1.52 -0.181 0 CA-C-O 119.628 -0.225 . . . . 0.0 110.558 -171.877 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 41.5 mp0 . . . . . 0 N--CA 1.45 -0.454 0 N-CA-C 108.733 -0.839 . . . . 0.0 108.733 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 20.1 m -79.02 151.48 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 173.371 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -93.15 -175.93 4.0 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 123.832 0.853 . . . . 0.0 111.179 178.221 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -46.72 -66.08 0.46 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.109 0.964 . . . . 0.0 112.622 175.458 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 10.3 tp-100 -61.39 -35.1 76.54 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 119.756 1.162 . . . . 0.0 111.454 -174.056 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -64.51 -42.51 95.77 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 119.408 1.004 . . . . 0.0 111.252 175.424 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 73' ' ' TYR . . . . . 0.408 ' CE2' ' HB2' ' B' ' 16' ' ' PHE . 0.3 OUTLIER -54.81 -52.7 61.87 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 121.286 -0.884 . . . . 0.0 109.686 170.069 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 20.8 mm -53.68 -40.61 43.53 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.375 0 C-N-CA 122.947 0.499 . . . . 0.0 109.665 177.999 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 91.5 m -63.63 -28.37 69.87 Favored 'General case' 0 C--N 1.332 -0.178 0 C-N-CA 123.592 0.757 . . . . 0.0 111.338 178.307 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 10.7 t80 -60.51 -54.51 44.66 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.384 0.993 . . . . 0.0 108.996 171.508 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 70.1 mt -64.44 -37.98 89.44 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.183 0.593 . . . . 0.0 111.703 179.889 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -70.63 -45.03 55.6 Favored Glycine 0 CA--C 1.523 0.541 0 N-CA-C 110.047 -1.221 . . . . 0.0 110.047 -176.895 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.88 -46.24 90.25 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 122.294 -0.533 . . . . 0.0 109.898 173.456 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 26.4 tp -51.52 -57.99 7.55 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.211 0.529 . . . . 0.0 109.882 175.132 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.14 -51.99 38.84 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 124.42 1.088 . . . . 0.0 110.691 177.502 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 57.7 ttm -56.47 -51.01 70.06 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 124.316 1.047 . . . . 0.0 110.82 -178.515 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.3 mt -66.35 -51.03 63.02 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 CA-C-O 118.088 -0.958 . . . . 0.0 109.882 -173.507 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.464 0.1 OUTLIER -76.98 -40.25 47.47 Favored 'General case' 0 C--N 1.347 0.478 0 CA-C-N 119.716 1.144 . . . . 0.0 113.373 -177.302 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 19.3 m-80 -82.98 64.88 7.83 Favored 'General case' 0 N--CA 1.461 0.077 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 169.166 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -47.38 -26.49 1.32 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.945 1.698 . . . . 0.0 113.961 -172.018 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -38.81 -45.16 1.11 Allowed 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.505 1.522 . . . . 0.0 111.92 167.503 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 86.8 mt . . . . . 0 CA--C 1.535 0.394 0 C-N-CA 125.235 1.414 . . . . 0.0 113.758 -177.789 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.197 0 CA-C-O 121.461 0.648 . . . . 0.0 111.98 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -53.5 163.82 0.95 Allowed Pre-proline 0 CA--C 1.54 0.568 0 C-N-CA 126.404 1.881 . . . . 0.0 111.627 172.552 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -51.65 -47.48 26.07 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 122.804 2.336 . . . . 0.0 112.309 176.239 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.421 HD23 ' HA ' ' A' ' 5' ' ' LEU . 8.6 mt -58.41 -50.43 73.71 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-N 118.322 0.51 . . . . 0.0 110.696 175.508 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -53.89 -48.81 69.73 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.147 0.431 . . . . 0.0 109.917 -178.119 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -57.78 -52.48 65.28 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.864 0.865 . . . . 0.0 110.919 177.655 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.31 -44.53 87.58 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.272 0.629 . . . . 0.0 111.781 -174.846 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 80.8 mt -54.54 -51.62 48.42 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 170.221 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.28 -49.64 14.37 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 124.358 0.98 . . . . 0.0 111.773 173.842 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.1 mt -55.61 -56.7 17.27 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 117.642 0.721 . . . . 0.0 111.094 174.561 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 9.9 mp -58.0 -43.39 86.58 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 119.357 0.98 . . . . 0.0 111.926 -177.885 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 75.4 mt -57.46 -55.88 18.5 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 C-N-CA 123.642 0.777 . . . . 0.0 110.131 174.035 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.81 -48.37 72.63 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.519 -1.032 . . . . 0.0 110.519 -177.293 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 7.4 mm -53.49 -48.57 57.8 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 C-N-CA 123.89 0.876 . . . . 0.0 109.975 174.278 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -56.47 -59.87 4.35 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.533 0.606 . . . . 0.0 109.96 177.076 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.6 t-80 -52.29 -38.34 58.12 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.218 1.007 . . . . 0.0 111.583 -177.014 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -56.51 -29.29 61.67 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.276 1.03 . . . . 0.0 112.163 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -110.8 -40.21 4.61 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.383 0.673 . . . . 0.0 112.262 -179.568 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 85.8 p . . . . . 0 CA--C 1.53 0.189 0 CA-C-N 119.462 1.028 . . . . 0.0 111.0 178.983 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 19.2 p . . . . . 0 N--CA 1.448 -0.534 0 N-CA-C 110.497 -0.186 . . . . 0.0 110.497 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -160.74 167.1 27.55 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 124.808 1.243 . . . . 0.0 108.219 168.553 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 6.5 t -121.12 -169.88 1.92 Allowed 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 122.391 1.091 . . . . 0.0 113.575 -172.75 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 43.5 pttt -45.97 -55.76 6.4 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 127.879 2.472 . . . . 0.0 113.564 -169.904 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -56.3 -51.83 66.76 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 -178.019 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -57.98 -41.62 83.34 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.386 0.675 . . . . 0.0 110.891 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 42.3 mt -65.73 -48.76 70.83 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.496 0.589 . . . . 0.0 111.862 178.658 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -58.3 -46.15 86.66 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 121.786 -0.571 . . . . 0.0 109.805 176.771 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -58.05 -49.33 77.26 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-O 118.889 -0.577 . . . . 0.0 110.42 174.575 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.1 mt -48.24 -52.3 21.67 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 119.513 1.051 . . . . 0.0 110.114 177.857 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 49.3 mt -56.56 -62.63 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.206 174.098 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.5 tt0 -49.2 -46.74 46.1 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.325 0.65 . . . . 0.0 112.599 -173.846 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.9 mmpt? -80.94 -53.92 6.03 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 125.592 1.557 . . . . 0.0 110.149 -171.319 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -95.22 -14.57 23.94 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -168.005 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.7 mt . . . . . 0 C--N 1.337 0.034 0 C-N-CA 125.327 1.451 . . . . 0.0 108.059 173.3 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.6 p-10 . . . . . 0 N--CA 1.464 0.267 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -36.2 -58.82 0.66 Allowed 'General case' 0 C--O 1.226 -0.17 0 C-N-CA 125.352 1.461 . . . . 0.0 113.593 -173.208 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -65.74 -39.87 91.55 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 120.771 0.319 . . . . 0.0 111.057 -173.076 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.68 HD12 ' H ' ' A' ' 53' ' ' ILE . 2.1 mp -61.14 -54.88 29.16 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 178.933 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 80.6 t -56.25 -45.31 81.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 C-N-CA 123.973 0.909 . . . . 0.0 110.285 -179.742 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.19 -52.83 63.73 Favored 'General case' 0 C--O 1.23 0.053 0 CA-C-N 118.846 0.748 . . . . 0.0 110.235 176.367 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 61.5 mt -55.0 -40.44 70.13 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 119.282 -0.39 . . . . 0.0 111.192 -179.483 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.25 -67.74 0.44 Allowed 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 118.523 0.601 . . . . 0.0 109.645 174.23 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -39.7 -41.3 1.06 Allowed 'General case' 0 C--N 1.34 0.152 0 C-N-CA 127.37 2.268 . . . . 0.0 112.097 -177.125 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -38.64 -49.96 1.58 Allowed 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.825 1.25 . . . . 0.0 112.19 175.997 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.7 pp -60.87 -41.56 96.19 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 118.333 0.515 . . . . 0.0 110.95 -176.839 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -71.46 -42.72 67.82 Favored 'General case' 0 N--CA 1.457 -0.11 0 C-N-CA 123.619 0.768 . . . . 0.0 109.762 -178.492 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 14.5 ttm180 . . . . . 0 N--CA 1.453 -0.308 0 C-N-CA 123.894 0.877 . . . . 0.0 110.208 178.464 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 . . . . . 0 CA--C 1.534 0.328 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 11.0 m -79.55 143.3 12.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 170.206 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -83.38 167.81 17.18 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 122.78 0.432 . . . . 0.0 111.382 177.992 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 61.1 t80 -37.4 -59.18 0.78 Allowed 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.508 1.123 . . . . 0.0 113.149 177.143 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 53.8 tp60 -64.9 -32.22 73.82 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 119.716 1.144 . . . . 0.0 111.153 -175.738 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -68.87 -40.27 79.38 Favored 'General case' 0 CA--C 1.533 0.304 0 O-C-N 121.537 -0.727 . . . . 0.0 110.539 176.672 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -56.14 -51.94 66.13 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 169.584 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.416 ' CG2' ' CG2' ' B' ' 74' ' ' ILE . 24.5 mm -56.78 -35.86 47.5 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 O-C-N 121.915 -0.491 . . . . 0.0 110.305 176.669 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 90.2 m -71.69 -34.52 69.73 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 119.217 0.917 . . . . 0.0 111.42 176.839 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -58.73 -51.93 67.86 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 119.106 0.866 . . . . 0.0 108.923 171.631 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 64.3 mt -59.96 -40.92 90.68 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 120.926 0.393 . . . . 0.0 111.322 174.159 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -59.7 -47.28 91.69 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 110.533 -1.027 . . . . 0.0 110.533 -179.772 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.03 -48.3 82.4 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.925 0.89 . . . . 0.0 109.694 176.311 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 8.9 tp -51.06 -60.27 3.28 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-O 121.981 0.896 . . . . 0.0 110.002 177.031 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -49.14 -54.93 14.02 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 125.518 1.527 . . . . 0.0 110.528 179.098 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 18.4 ttp -67.92 -33.6 75.0 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.772 0.829 . . . . 0.0 111.99 -174.199 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 90.9 mt -67.49 -58.42 6.29 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.346 0 CA-C-O 118.407 -0.806 . . . . 0.0 108.99 176.3 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.417 0.7 OUTLIER -70.8 -38.89 73.37 Favored 'General case' 0 C--N 1.346 0.436 0 C-N-CA 118.173 -1.411 . . . . 0.0 112.521 -174.542 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 29.7 m-80 -82.18 65.44 7.31 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 168.903 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -46.99 -32.58 3.99 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.517 1.127 . . . . 0.0 113.004 -172.104 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.94 -52.25 0.43 Allowed 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.85 1.66 . . . . 0.0 112.494 168.633 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 90.1 mt . . . . . 0 CA--C 1.533 0.308 0 C-N-CA 124.2 1.0 . . . . 0.0 113.455 -174.634 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.216 0 CA-C-O 120.847 0.356 . . . . 0.0 110.222 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.7 m -51.26 159.86 1.02 Allowed Pre-proline 0 CA--C 1.537 0.468 0 C-N-CA 124.959 1.304 . . . . 0.0 110.688 173.625 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_exo -44.81 -49.87 9.09 Favored 'Trans proline' 0 N--CA 1.459 -0.52 0 C-N-CA 123.276 2.65 . . . . 0.0 113.401 -178.423 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.4 mt -57.95 -53.42 58.47 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 174.788 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -58.35 -40.44 82.22 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 118.265 0.484 . . . . 0.0 110.029 -175.741 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -64.12 -50.69 67.27 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.462 1.105 . . . . 0.0 110.52 178.605 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.35 -46.12 91.54 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.602 0.715 . . . . 0.0 111.103 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 64.9 mt -52.8 -53.01 23.13 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 170.139 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.76 -47.25 24.75 Favored Glycine 0 CA--C 1.527 0.796 0 C-N-CA 125.172 1.368 . . . . 0.0 111.784 176.082 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 mt -55.93 -55.34 33.82 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 117.606 0.703 . . . . 0.0 110.89 173.63 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -57.54 -43.66 84.55 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 118.864 0.757 . . . . 0.0 111.612 -179.83 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 89.1 mt -58.35 -52.75 55.32 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 C-N-CA 123.554 0.741 . . . . 0.0 110.69 174.414 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.0 -51.97 50.08 Favored Glycine 0 CA--C 1.523 0.543 0 N-CA-C 109.614 -1.394 . . . . 0.0 109.614 -178.026 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 9.1 mm -53.51 -49.93 52.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 C-N-CA 123.635 0.774 . . . . 0.0 110.474 175.377 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -51.76 -59.46 4.28 Favored 'General case' 0 C--N 1.339 0.134 0 CA-C-O 120.929 0.395 . . . . 0.0 110.059 178.321 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 67.9 t60 -55.04 -46.39 75.31 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.262 0.625 . . . . 0.0 110.635 -177.632 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -51.15 -28.83 11.89 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 125.546 1.539 . . . . 0.0 112.721 -179.423 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -132.27 44.6 2.87 Favored 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 119.006 0.821 . . . . 0.0 110.01 173.367 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 58.6 p . . . . . 0 CA--C 1.533 0.305 0 CA-C-O 121.601 0.715 . . . . 0.0 111.769 -176.986 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 19.2 m80 . . . . . 0 CA--C 1.54 0.568 0 CA-C-O 119.755 -0.164 . . . . 0.0 111.358 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 3.4 p -128.84 169.85 14.08 Favored 'General case' 0 C--O 1.232 0.151 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 169.893 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 29' ' ' LEU . . . . . 0.427 HD12 ' CG2' ' B' ' 68' ' ' VAL . 4.3 pp -159.34 -170.84 3.1 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.593 0.757 . . . . 0.0 109.619 175.247 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 14.4 m -149.69 178.82 8.52 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.125 -0.984 . . . . 0.0 111.357 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 19.4 pttm -37.23 -53.2 1.06 Allowed 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 126.576 1.95 . . . . 0.0 113.727 -179.487 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 23.1 ttmm -50.98 -50.35 58.39 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.782 0.833 . . . . 0.0 110.544 178.119 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 25.8 mp0 -67.39 -39.01 85.56 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 118.723 -0.656 . . . . 0.0 110.143 -178.303 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 78.0 mt -60.36 -46.43 89.98 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.373 0.988 . . . . 0.0 111.127 175.476 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -56.8 -51.43 68.96 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 175.197 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -55.64 -48.22 75.33 Favored 'General case' 0 C--O 1.22 -0.448 0 CA-C-N 117.861 0.3 . . . . 0.0 111.361 175.982 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 15.1 mt -51.77 -53.52 38.84 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 121.504 -0.748 . . . . 0.0 109.776 -178.739 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 1.4 mp -57.13 -58.14 7.13 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 174.623 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -53.5 -47.77 69.58 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.574 0.75 . . . . 0.0 112.037 -172.085 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 10.7 mmpt? -82.66 -49.39 9.86 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 125.204 1.402 . . . . 0.0 110.211 -173.25 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 52.7 mm-40 -98.98 -2.47 37.29 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-O 117.248 -1.358 . . . . 0.0 114.424 -167.95 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 72.1 mt . . . . . 0 N--CA 1.462 0.175 0 CA-C-N 120.673 1.579 . . . . 0.0 110.214 169.666 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 . . . . . 0 N--CA 1.464 0.243 0 N-CA-C 114.959 1.466 . . . . 0.0 114.959 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.94 -60.58 0.16 Allowed 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 125.851 1.661 . . . . 0.0 113.524 -178.362 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -68.55 -34.57 76.08 Favored 'General case' 0 N--CA 1.457 -0.111 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -174.085 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 53' ' ' ILE . . . . . 0.509 HD12 ' N ' ' B' ' 53' ' ' ILE . 1.2 mp -65.87 -52.54 48.25 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 -178.657 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 80.3 t -54.31 -45.49 68.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 C-N-CA 123.699 0.799 . . . . 0.0 110.093 174.981 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.41 -50.64 72.36 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 118.482 0.583 . . . . 0.0 110.926 177.263 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 54.4 mt -56.19 -39.87 73.09 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.202 0.601 . . . . 0.0 111.284 178.685 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.44 -64.95 0.75 Allowed 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 118.762 0.71 . . . . 0.0 109.085 174.186 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -40.51 -42.51 1.66 Allowed 'General case' 0 N--CA 1.463 0.209 0 C-N-CA 126.637 1.975 . . . . 0.0 111.943 -178.147 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -38.13 -48.65 1.26 Allowed 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 126.001 1.72 . . . . 0.0 112.634 177.931 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.6 pp -63.11 -42.23 99.51 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 121.078 -0.249 . . . . 0.0 110.833 -176.288 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -73.59 -37.76 65.34 Favored 'General case' 0 N--CA 1.457 -0.085 0 C-N-CA 123.791 0.836 . . . . 0.0 110.257 -178.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 15.6 ttm180 -58.38 -48.5 80.4 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.325 0.65 . . . . 0.0 109.614 175.092 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 . . . . . 0 C--O 1.232 0.166 0 C-N-CA 122.222 0.209 . . . . 0.0 111.311 -174.412 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 26.9 mp0 . . . . . 0 N--CA 1.453 -0.277 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 68' ' ' VAL . . . . . 0.427 ' CG2' HD12 ' B' ' 29' ' ' LEU . 29.5 m -85.91 155.86 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 CA-C-O 121.33 0.586 . . . . 0.0 109.896 -177.686 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 16.7 p30 -105.17 -176.79 3.18 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 126.184 1.794 . . . . 0.0 110.928 179.426 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -52.93 -63.48 1.13 Allowed 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 123.637 0.775 . . . . 0.0 112.183 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -62.76 -32.68 73.87 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 119.703 1.138 . . . . 0.0 111.327 -175.487 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -59.16 -50.52 73.72 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 119.525 1.057 . . . . 0.0 110.666 173.564 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -53.9 -49.75 67.9 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.957 -0.464 . . . . 0.0 110.227 173.245 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 0.416 ' CG2' ' CG2' ' A' ' 74' ' ' ILE . 26.2 mm -60.85 -27.18 40.65 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 O-C-N 121.934 -0.479 . . . . 0.0 111.18 177.343 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 83.6 m -76.12 -33.94 59.46 Favored 'General case' 0 C--N 1.333 -0.114 0 O-C-N 120.898 -1.126 . . . . 0.0 110.154 173.698 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -57.34 -57.98 10.26 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 169.831 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 48.4 mt -61.37 -40.31 93.84 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 120.943 0.401 . . . . 0.0 111.996 179.127 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.3 -47.06 65.81 Favored Glycine 0 CA--C 1.524 0.651 0 N-CA-C 110.721 -0.952 . . . . 0.0 110.721 -176.461 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.28 -44.58 87.54 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 121.867 -0.784 . . . . 0.0 110.174 176.228 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 13.9 tp -48.29 -56.83 7.04 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.604 0.761 . . . . 0.0 110.145 172.55 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.05 -55.0 23.39 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.474 1.11 . . . . 0.0 110.612 175.795 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 39.5 ttm -51.33 -47.13 62.79 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.243 1.017 . . . . 0.0 110.982 -178.136 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 60.6 mt -68.8 -61.21 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-O 118.321 -0.847 . . . . 0.0 110.566 178.701 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.39 0.3 OUTLIER -65.7 -44.47 86.06 Favored 'General case' 0 C--N 1.346 0.434 0 C-N-CA 117.891 -1.524 . . . . 0.0 112.02 -171.331 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 64.7 m-80 -82.94 62.57 6.57 Favored 'General case' 0 C--O 1.228 -0.047 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 169.594 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -49.21 -30.07 6.49 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.196 1.398 . . . . 0.0 112.268 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -40.37 -37.94 0.74 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.795 1.638 . . . . 0.0 113.138 169.65 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 28.5 mt . . . . . 0 CA--C 1.53 0.185 0 C-N-CA 123.788 0.835 . . . . 0.0 111.988 176.831 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.258 0 CA-C-O 121.084 0.468 . . . . 0.0 110.75 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.1 m -57.39 165.78 1.95 Allowed Pre-proline 0 CA--C 1.54 0.594 0 C-N-CA 124.915 1.286 . . . . 0.0 111.885 178.039 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -47.19 -47.43 17.11 Favored 'Trans proline' 0 N--CA 1.458 -0.578 0 C-N-CA 123.575 2.85 . . . . 0.0 113.376 178.735 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.7 mt -55.42 -49.62 71.93 Favored 'General case' 0 C--N 1.341 0.204 0 CA-C-N 118.01 0.368 . . . . 0.0 111.495 173.852 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -61.52 -41.31 97.13 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 -176.391 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 17.0 tt0 -60.48 -51.78 67.99 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.33 0.652 . . . . 0.0 110.831 175.855 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.06 -45.83 90.35 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.527 0.731 . . . . 0.0 111.227 -177.296 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 66.7 mt -53.1 -53.5 22.16 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 169.923 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -45.78 -47.83 13.49 Favored Glycine 0 CA--C 1.528 0.902 0 C-N-CA 125.188 1.375 . . . . 0.0 112.156 175.494 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.0 mt -54.95 -56.48 19.19 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 117.733 0.766 . . . . 0.0 110.861 173.929 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.4 mp -58.17 -43.95 87.73 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 121.611 -0.681 . . . . 0.0 111.601 -179.285 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 60.7 mt -55.41 -56.04 13.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.18 0 C-N-CA 123.727 0.811 . . . . 0.0 109.975 174.025 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.01 -49.63 61.92 Favored Glycine 0 CA--C 1.523 0.56 0 N-CA-C 110.268 -1.133 . . . . 0.0 110.268 -177.547 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 8.8 mm -53.34 -48.5 56.16 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 C-N-CA 123.242 0.617 . . . . 0.0 110.454 176.52 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -56.54 -60.93 2.82 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 121.684 0.754 . . . . 0.0 109.892 175.934 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -53.76 -37.39 63.36 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.854 1.262 . . . . 0.0 111.616 -172.659 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.5 tttp -50.28 -36.92 33.59 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.2 1.0 . . . . 0.0 111.855 177.151 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -102.28 -52.14 3.2 Favored 'General case' 0 CA--C 1.528 0.111 0 C-N-CA 123.064 0.545 . . . . 0.0 109.682 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.6 m . . . . . 0 N--CA 1.453 -0.292 0 O-C-N 121.759 -0.588 . . . . 0.0 112.431 -175.549 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.9 p . . . . . 0 N--CA 1.453 -0.309 0 CA-C-O 121.08 0.467 . . . . 0.0 111.431 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -151.62 164.34 37.1 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 124.088 0.955 . . . . 0.0 109.079 168.12 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 84.3 p -87.04 165.28 15.93 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.66 1.184 . . . . 0.0 113.125 -172.834 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 24.2 pttm -48.83 -47.34 42.54 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.395 168.075 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -57.28 -53.28 59.88 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 124.542 1.137 . . . . 0.0 109.37 178.536 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -56.62 -43.65 80.42 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 118.208 -0.901 . . . . 0.0 111.812 178.146 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.8 mt -60.4 -52.29 65.84 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 119.881 1.219 . . . . 0.0 111.597 175.549 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.9 mtmt -58.48 -38.21 77.12 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 122.374 0.27 . . . . 0.0 110.803 -178.565 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -60.62 -70.39 0.18 Allowed 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 168.824 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.3 mt -32.16 -60.23 0.28 Allowed 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 126.175 1.79 . . . . 0.0 112.341 -176.397 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 15.4 tt -56.34 -54.17 31.21 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 O-C-N 123.464 0.477 . . . . 0.0 109.874 -173.592 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -69.01 -40.46 78.66 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.851 -0.531 . . . . 0.0 111.733 -176.389 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.8 mmpt? -60.93 -54.26 47.14 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 123.692 0.797 . . . . 0.0 109.691 -178.841 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 65.8 mm-40 -84.68 -49.96 8.05 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.399 -169.728 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 98.4 mt . . . . . 0 C--N 1.339 0.128 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 170.428 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 . . . . . 0 N--CA 1.462 0.165 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -36.87 -51.16 0.89 Allowed 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 124.661 1.184 . . . . 0.0 112.799 179.672 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -65.95 -39.32 90.34 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 121.256 0.55 . . . . 0.0 111.103 -175.195 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.509 ' N ' HD12 ' A' ' 53' ' ' ILE . 1.1 mp -65.36 -51.98 57.71 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 N-CA-C 106.904 -1.517 . . . . 0.0 106.904 -179.708 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 84.6 t -56.69 -44.17 80.76 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 C-N-CA 123.892 0.877 . . . . 0.0 110.324 178.853 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -56.65 -53.45 57.5 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 118.65 0.659 . . . . 0.0 110.195 173.945 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 40.8 mt -53.13 -44.3 67.61 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 119.204 -0.427 . . . . 0.0 111.521 178.662 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 26.2 mmt -64.89 -57.82 7.79 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.797 0.808 . . . . 0.0 109.885 177.71 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -56.29 -32.94 65.05 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 125.272 1.429 . . . . 0.0 111.835 -173.547 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -38.59 -47.66 1.34 Allowed 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 125.314 1.446 . . . . 0.0 112.397 -178.191 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -55.83 -48.33 75.65 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 122.348 0.259 . . . . 0.0 110.708 -178.719 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -67.61 -45.34 75.72 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 123.139 0.576 . . . . 0.0 110.198 176.932 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 14.2 ttt85 . . . . . 0 CA--C 1.533 0.291 0 C-N-CA 123.954 0.902 . . . . 0.0 111.014 -178.932 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.5 mp0 . . . . . 0 CA--C 1.53 0.198 0 CA-C-O 120.202 0.049 . . . . 0.0 111.107 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 15.5 m -137.03 156.31 34.13 Favored 'Isoleucine or valine' 0 C--O 1.235 0.303 0 C-N-CA 125.37 1.468 . . . . 0.0 108.844 168.882 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -88.67 168.48 12.48 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 124.016 0.926 . . . . 0.0 111.622 175.142 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -36.63 -62.0 0.49 Allowed 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.512 1.125 . . . . 0.0 113.447 172.79 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 43.7 tp60 -63.29 -34.09 76.94 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 120.851 -1.156 . . . . 0.0 111.235 -174.28 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -66.28 -41.4 89.87 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.366 -0.834 . . . . 0.0 110.371 175.702 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -54.49 -49.27 70.53 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 121.614 -0.678 . . . . 0.0 109.651 169.74 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.407 ' CG2' ' CG2' ' B' ' 74' ' ' ILE . 29.6 mm -58.65 -32.8 47.09 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 O-C-N 121.764 -0.585 . . . . 0.0 110.676 175.3 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 25.5 m -72.13 -30.97 65.58 Favored 'General case' 0 CA--C 1.534 0.345 0 O-C-N 121.232 -0.917 . . . . 0.0 111.253 175.363 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -61.77 -56.48 19.05 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.083 -1.011 . . . . 0.0 108.739 171.76 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 49.2 mt -61.49 -41.97 98.08 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 120.875 0.369 . . . . 0.0 111.418 178.865 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.8 -46.36 89.88 Favored Glycine 0 CA--C 1.523 0.587 0 N-CA-C 110.663 -0.975 . . . . 0.0 110.663 -178.215 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.97 -45.91 92.84 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 117.97 0.885 . . . . 0.0 110.423 174.758 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 16.8 tp -51.73 -55.74 17.85 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.18 0.514 . . . . 0.0 109.807 176.445 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.83 -56.14 15.74 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 124.75 1.22 . . . . 0.0 110.163 179.261 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 54.5 ttm -50.43 -52.6 36.32 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 125.6 1.56 . . . . 0.0 110.574 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 71.3 mt -64.84 -64.41 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.346 0 CA-C-O 118.748 -0.644 . . . . 0.0 109.403 -177.923 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.448 0.1 OUTLIER -67.47 -37.1 82.39 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 118.314 -1.354 . . . . 0.0 113.253 -169.245 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 24.1 m-80 -81.51 68.79 7.98 Favored 'General case' 0 N--CA 1.461 0.101 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 170.054 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -37.62 -46.64 0.88 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.503 1.521 . . . . 0.0 111.619 -176.074 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -30.93 -53.51 0.19 Allowed 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 126.756 2.022 . . . . 0.0 113.506 171.502 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 18.7 mt . . . . . 0 C--O 1.224 -0.261 0 C-N-CA 123.996 0.919 . . . . 0.0 111.95 -178.293 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.239 0 CA-C-O 120.794 0.33 . . . . 0.0 110.621 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 13.0 m -50.74 156.37 1.63 Allowed Pre-proline 0 CA--C 1.542 0.656 0 C-N-CA 123.56 0.744 . . . . 0.0 111.008 170.668 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -47.11 -51.5 9.29 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 123.23 2.62 . . . . 0.0 113.465 -178.01 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 4.9 mt -52.79 -46.89 67.84 Favored 'General case' 0 C--O 1.227 -0.124 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 172.418 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -63.48 -40.62 97.58 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 118.16 0.436 . . . . 0.0 110.1 -177.045 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 14.1 tp60 -63.4 -46.3 87.07 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 122.438 0.295 . . . . 0.0 110.7 175.47 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.76 -47.02 85.33 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.357 0.599 . . . . 0.0 110.872 -179.157 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 65.1 mt -53.15 -53.39 23.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 169.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.29 -44.8 21.11 Favored Glycine 0 CA--C 1.527 0.822 0 C-N-CA 125.588 1.566 . . . . 0.0 112.02 176.49 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.6 mt -57.27 -55.57 33.11 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 117.569 0.685 . . . . 0.0 110.587 173.612 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.9 mp -57.86 -41.99 83.58 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 118.996 0.816 . . . . 0.0 111.647 179.789 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 66.7 mt -57.13 -56.37 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 C-N-CA 123.841 0.856 . . . . 0.0 110.736 173.448 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.07 -50.55 58.62 Favored Glycine 0 CA--C 1.521 0.444 0 N-CA-C 109.751 -1.34 . . . . 0.0 109.751 -177.206 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 12.5 mm -52.1 -49.06 41.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 C-N-CA 123.47 0.708 . . . . 0.0 110.474 174.341 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -55.49 -65.36 0.6 Allowed 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 118.31 0.505 . . . . 0.0 110.18 178.335 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -58.92 -30.67 68.01 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 118.205 -0.902 . . . . 0.0 112.707 -174.398 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 65.3 tttp -49.13 -36.71 19.75 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 119.301 0.955 . . . . 0.0 111.293 173.33 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -100.68 -56.73 2.26 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 122.935 0.494 . . . . 0.0 110.169 177.459 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 CA--C 1.533 0.326 0 CA-C-N 118.832 0.742 . . . . 0.0 111.589 -176.83 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 23.6 t-160 . . . . . 0 N--CA 1.451 -0.393 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 32.2 p -133.48 160.83 36.25 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 125.177 1.391 . . . . 0.0 111.429 -174.208 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -161.34 177.72 9.88 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.831 1.252 . . . . 0.0 108.668 168.477 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.4 t -131.83 -169.44 2.2 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 120.259 1.39 . . . . 0.0 112.241 -175.112 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 19.2 pttp -42.25 -53.54 4.07 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 127.877 2.471 . . . . 0.0 113.227 -174.062 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 3.2 tppp? -55.67 -53.41 56.94 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 123.517 0.727 . . . . 0.0 109.568 -178.868 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 28.2 mp0 -64.44 -38.04 89.64 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.289 -176.65 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 43.6 mt -61.9 -52.59 63.46 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 118.542 0.61 . . . . 0.0 111.228 177.591 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -61.88 -43.78 98.14 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.545 -0.722 . . . . 0.0 110.506 178.413 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 71.6 tt0 -53.24 -51.96 60.51 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.758 0.823 . . . . 0.0 110.363 174.949 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 7.9 mt -49.49 -56.95 8.01 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 124.552 1.141 . . . . 0.0 110.13 177.391 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 33.7 mm -53.92 -58.99 2.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 177.503 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -54.31 -47.06 72.88 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.272 0.629 . . . . 0.0 112.425 -172.166 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -78.1 -56.28 4.6 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 122.096 -0.377 . . . . 0.0 110.745 -178.316 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -82.59 -20.55 36.26 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 -167.163 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 76.1 mt . . . . . 0 N--CA 1.457 -0.115 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 168.779 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 . . . . . 0 C--O 1.226 -0.136 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.4 -57.41 0.15 Allowed 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 126.027 1.731 . . . . 0.0 113.906 -178.896 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -67.4 -41.91 84.15 Favored 'General case' 0 N--CA 1.457 -0.083 0 CA-C-O 120.849 0.356 . . . . 0.0 111.166 -174.773 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 53' ' ' ILE . . . . . 0.612 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.4 mp -60.65 -52.08 65.64 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 N-CA-C 107.066 -1.457 . . . . 0.0 107.066 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 78.4 t -54.49 -53.37 31.52 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 C-N-CA 123.914 0.886 . . . . 0.0 109.428 177.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -50.28 -55.17 16.57 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 119.317 0.962 . . . . 0.0 110.927 176.932 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 68.1 mt -54.67 -43.47 72.45 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 122.593 0.357 . . . . 0.0 111.655 -175.785 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -75.55 -59.67 2.65 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 118.097 0.408 . . . . 0.0 111.09 177.857 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -40.88 -43.71 2.12 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 126.458 1.903 . . . . 0.0 111.447 178.773 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -38.52 -49.01 1.47 Allowed 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 125.046 1.338 . . . . 0.0 112.547 176.636 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -58.6 -47.02 85.72 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 -176.814 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -67.91 -44.04 77.85 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 122.736 0.415 . . . . 0.0 110.724 178.44 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 11.2 ttp180 -56.55 -46.28 80.79 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.664 0.786 . . . . 0.0 110.095 -178.657 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 . . . . . 0 N--CA 1.454 -0.236 0 C-N-CA 122.879 0.472 . . . . 0.0 111.179 -174.904 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 . . . . . 0 N--CA 1.452 -0.359 0 N-CA-C 106.237 -1.764 . . . . 0.0 106.237 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 12.2 m -78.17 140.22 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 -179.181 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -81.36 167.06 19.88 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.551 0.215 . . . . 0.0 110.71 175.95 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -32.37 -61.04 0.27 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.978 1.311 . . . . 0.0 112.902 171.589 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 37.8 tp60 -61.35 -33.3 73.39 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.604 1.093 . . . . 0.0 112.128 -174.726 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -72.53 -38.77 67.94 Favored 'General case' 0 C--O 1.236 0.35 0 O-C-N 121.338 -0.851 . . . . 0.0 110.16 177.87 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -56.14 -50.74 70.27 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 169.675 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 0.407 ' CG2' ' CG2' ' A' ' 74' ' ' ILE . 25.8 mm -55.82 -41.17 65.31 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 175.985 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 58.4 m -60.03 -37.95 81.28 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 118.976 0.807 . . . . 0.0 110.94 176.561 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 20.7 t80 -57.09 -53.97 52.1 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 121.726 -0.608 . . . . 0.0 109.842 174.223 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 60.2 mt -62.98 -38.27 90.45 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.979 0.419 . . . . 0.0 111.893 179.113 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.65 -43.51 84.99 Favored Glycine 0 CA--C 1.522 0.508 0 N-CA-C 110.0 -1.24 . . . . 0.0 110.0 -178.414 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.74 -48.31 82.37 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 117.553 0.676 . . . . 0.0 109.881 173.438 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 9.1 tp -50.39 -57.7 7.37 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 121.429 0.633 . . . . 0.0 110.054 175.426 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.5 -56.64 10.71 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 124.877 1.271 . . . . 0.0 110.433 179.018 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 43.8 ttm -52.57 -49.66 64.51 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 125.555 1.542 . . . . 0.0 110.665 -179.409 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 58.3 mt -69.84 -50.02 52.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-O 117.894 -1.051 . . . . 0.0 110.262 -172.503 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.451 1.2 p90 -76.52 -37.93 55.94 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 120.166 1.348 . . . . 0.0 113.381 -178.573 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -81.29 67.4 7.21 Favored 'General case' 0 N--CA 1.463 0.203 0 O-C-N 121.102 -0.999 . . . . 0.0 108.692 173.158 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -41.54 -42.03 2.29 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.259 1.424 . . . . 0.0 111.464 179.303 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.5 -47.67 0.23 Allowed 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 126.192 1.797 . . . . 0.0 113.575 172.063 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 47.7 mt . . . . . 0 N--CA 1.457 -0.082 0 C-N-CA 122.807 0.443 . . . . 0.0 110.832 178.431 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.236 0 CA-C-O 120.737 0.303 . . . . 0.0 110.533 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.1 m -51.13 157.62 1.46 Allowed Pre-proline 0 CA--C 1.538 0.488 0 C-N-CA 125.031 1.332 . . . . 0.0 111.427 176.272 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_exo -46.45 -49.64 11.53 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 123.28 2.653 . . . . 0.0 112.929 -179.188 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.0 mt -58.54 -45.78 88.17 Favored 'General case' 0 C--O 1.225 -0.217 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 175.489 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -61.34 -43.26 99.16 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-N 118.3 0.5 . . . . 0.0 109.656 -177.658 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -60.71 -49.78 76.13 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.518 0.727 . . . . 0.0 110.573 176.413 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.47 -45.89 90.96 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.276 0.63 . . . . 0.0 111.388 -178.349 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 65.5 mt -53.78 -51.64 42.29 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 170.463 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.73 -48.84 17.59 Favored Glycine 0 CA--C 1.527 0.81 0 C-N-CA 124.733 1.159 . . . . 0.0 112.013 174.591 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.1 mt -55.51 -56.49 19.66 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 117.749 0.775 . . . . 0.0 111.062 174.875 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.23 -42.74 86.97 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 118.586 0.63 . . . . 0.0 111.451 -178.574 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 79.0 mt -58.24 -52.34 60.03 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 C-N-CA 123.578 0.751 . . . . 0.0 110.586 173.815 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.72 -50.65 59.7 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.069 -1.212 . . . . 0.0 110.069 -178.378 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 8.6 mm -52.94 -48.82 50.98 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 C-N-CA 123.306 0.642 . . . . 0.0 110.093 175.132 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -55.57 -59.01 5.43 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 120.71 0.291 . . . . 0.0 110.527 177.634 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 5.6 t-80 -55.36 -39.83 70.55 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 124.252 1.021 . . . . 0.0 111.061 -175.544 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -48.25 -34.49 10.39 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.653 0.781 . . . . 0.0 112.064 -178.37 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -107.16 -53.59 2.59 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.41 0.684 . . . . 0.0 109.793 178.1 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.8 m . . . . . 0 N--CA 1.454 -0.241 0 C-N-CA 123.894 0.878 . . . . 0.0 112.267 -172.909 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 6.9 p . . . . . 0 CA--C 1.533 0.294 0 CA-C-O 120.771 0.319 . . . . 0.0 110.84 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -154.44 174.63 14.62 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 124.342 1.057 . . . . 0.0 109.258 169.608 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.6 p -127.0 168.06 15.06 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.52 1.128 . . . . 0.0 112.831 -171.649 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.3 pttp -32.26 -61.34 0.26 Allowed 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 127.515 2.326 . . . . 0.0 113.921 177.47 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 20.5 tptp -54.66 -47.25 73.78 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 121.881 -0.512 . . . . 0.0 111.368 -179.27 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -61.81 -40.99 97.19 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 119.183 -0.437 . . . . 0.0 109.932 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 26.2 mt -63.13 -48.38 78.72 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 118.264 0.484 . . . . 0.0 111.437 176.535 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 9.1 mtpm? -61.93 -36.55 81.7 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.291 0.636 . . . . 0.0 110.966 179.193 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.58 -54.22 30.96 Favored 'General case' 0 C--O 1.224 -0.262 0 O-C-N 122.103 -0.373 . . . . 0.0 110.656 169.959 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.1 mt -43.77 -71.93 0.07 Allowed 'General case' 0 C--O 1.227 -0.108 0 C-N-CA 124.638 1.175 . . . . 0.0 110.29 178.288 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 12.9 tt -50.72 -50.66 22.26 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 CA-C-O 121.777 0.799 . . . . 0.0 110.212 -170.582 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -53.9 -47.13 71.45 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 126.324 1.85 . . . . 0.0 111.87 177.657 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.26 -55.37 5.78 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.944 0.498 . . . . 0.0 110.658 -175.668 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . 0.261 0.0 OUTLIER -91.27 -7.58 50.75 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 114.898 1.444 . . . . 0.0 114.898 -168.587 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 62.5 mt . . . . . 0 C--O 1.231 0.109 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 167.893 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 . . . . . 0 CA--C 1.531 0.217 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -28.53 -57.53 0.13 Allowed 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 126.909 2.083 . . . . 0.0 113.89 178.025 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 63.4 tt0 -66.84 -40.99 88.15 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 121.075 0.464 . . . . 0.0 110.901 -173.714 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.608 HD12 ' H ' ' A' ' 53' ' ' ILE . 1.8 mp -64.8 -51.24 69.6 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 -179.776 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 82.8 t -55.68 -43.06 72.03 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 C-N-CA 123.964 0.906 . . . . 0.0 110.098 177.559 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.27 -52.2 66.69 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 119.583 1.083 . . . . 0.0 111.003 174.673 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 37.5 mt -53.36 -41.44 65.84 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 119.491 -0.29 . . . . 0.0 111.401 179.156 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.5 -62.4 1.42 Allowed 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.399 0.545 . . . . 0.0 110.139 176.43 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -43.53 -39.98 3.7 Favored 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 126.996 2.118 . . . . 0.0 111.572 -177.436 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -39.0 -49.7 1.72 Allowed 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 124.165 0.986 . . . . 0.0 112.261 173.983 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.4 mp -60.84 -48.37 82.12 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 -177.394 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -61.29 -54.0 49.58 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.095 0.558 . . . . 0.0 109.73 179.601 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.6 ttm180 . . . . . 0 N--CA 1.453 -0.291 0 C-N-CA 124.599 1.16 . . . . 0.0 110.219 178.02 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 . . . . . 0 N--CA 1.453 -0.304 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.7 m -132.0 151.1 34.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 C-N-CA 125.791 1.636 . . . . 0.0 106.976 169.269 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -90.31 170.94 9.83 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 123.321 0.648 . . . . 0.0 111.037 175.253 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 73.6 t80 -34.51 -63.89 0.28 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.987 1.315 . . . . 0.0 113.123 171.926 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 50.3 tp60 -63.26 -32.34 73.73 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.768 1.167 . . . . 0.0 111.496 -173.064 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -68.45 -41.2 80.61 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 121.262 -0.899 . . . . 0.0 110.246 176.485 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -56.58 -50.54 71.64 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 170.994 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.6 mm -56.28 -38.3 54.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 O-C-N 121.848 -0.533 . . . . 0.0 110.087 176.463 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 90.4 m -66.63 -38.24 86.5 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 121.465 -0.772 . . . . 0.0 111.035 175.876 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -54.85 -54.49 41.68 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 172.759 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 53.8 mt -59.95 -40.89 90.56 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 111.763 0.283 . . . . 0.0 111.763 176.272 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.07 -47.05 91.8 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 110.895 -0.882 . . . . 0.0 110.895 -177.179 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.32 -45.21 81.09 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.37 0.668 . . . . 0.0 109.948 177.97 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 59.0 tp -49.53 -58.67 4.76 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.369 0.604 . . . . 0.0 109.983 173.573 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -48.59 -58.57 4.51 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 124.46 1.104 . . . . 0.0 110.294 176.006 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 56.5 ttm -50.89 -57.52 8.29 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 122.994 0.518 . . . . 0.0 110.883 -178.158 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 31.6 mt -61.04 -38.33 79.31 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 CA-C-O 117.937 -1.03 . . . . 0.0 110.91 -172.977 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.382 0.0 OUTLIER -97.05 7.65 46.19 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 115.229 1.566 . . . . 0.0 115.229 176.704 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -122.99 87.71 2.8 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 119.596 1.089 . . . . 0.0 109.883 169.229 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -38.48 -42.39 0.75 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 126.041 1.737 . . . . 0.0 113.796 176.173 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -45.93 -46.32 16.04 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.385 0.674 . . . . 0.0 111.625 176.571 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 91.6 mt . . . . . 0 CA--C 1.534 0.344 0 C-N-CA 123.618 0.767 . . . . 0.0 112.97 -177.567 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.175 0 CA-C-O 121.174 0.511 . . . . 0.0 110.112 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.4 m -56.17 164.17 1.99 Allowed Pre-proline 0 CA--C 1.54 0.558 0 C-N-CA 124.256 1.023 . . . . 0.0 111.339 174.646 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo -47.56 -50.52 11.29 Favored 'Trans proline' 0 N--CA 1.458 -0.602 0 C-N-CA 123.013 2.475 . . . . 0.0 112.72 177.632 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' B' ' 5' ' ' LEU . 1.7 mt -60.52 -39.68 88.66 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-O 118.887 -0.578 . . . . 0.0 112.423 174.889 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -61.11 -45.88 92.86 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 119.291 0.951 . . . . 0.0 109.152 -179.304 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.9 tp60 -63.81 -43.92 94.81 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.717 -0.22 . . . . 0.0 111.081 177.106 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.31 -46.76 75.8 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.741 -0.599 . . . . 0.0 111.408 -177.42 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 76.7 mt -55.3 -52.16 48.53 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 170.268 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -45.19 -47.33 10.56 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 124.897 1.237 . . . . 0.0 111.906 174.803 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.5 mt -56.36 -59.01 5.58 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.442 0.697 . . . . 0.0 110.518 173.654 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.6 mp -57.25 -42.35 81.37 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 119.496 1.044 . . . . 0.0 112.061 -177.631 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 55.9 mt -58.77 -56.82 14.23 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 123.953 0.901 . . . . 0.0 110.439 174.168 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.06 -49.14 69.06 Favored Glycine 0 CA--C 1.522 0.513 0 N-CA-C 110.193 -1.163 . . . . 0.0 110.193 -176.995 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 8.5 mm -50.48 -53.51 12.26 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 C-N-CA 124.393 1.077 . . . . 0.0 109.99 174.138 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -52.64 -62.98 1.3 Allowed 'General case' 0 CA--C 1.528 0.117 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 177.079 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -51.03 -39.52 56.08 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.92 0.888 . . . . 0.0 111.745 -175.066 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -52.22 -34.82 47.38 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.969 0.907 . . . . 0.0 111.982 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 94.6 m-85 -111.42 -35.61 5.77 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 118.3 0.5 . . . . 0.0 112.18 -177.098 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.6 m . . . . . 0 CA--C 1.532 0.257 0 CA-C-N 119.028 0.831 . . . . 0.0 111.003 174.701 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 38.8 p-80 . . . . . 0 CA--C 1.538 0.493 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 17.0 p -135.72 171.93 13.75 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 126.79 2.036 . . . . 0.0 106.352 174.684 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.91 168.58 24.33 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 118.756 0.707 . . . . 0.0 110.485 173.836 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.4 t -116.25 -178.57 3.44 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.341 1.056 . . . . 0.0 112.256 -175.835 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 55.0 mttm -35.68 -66.61 0.19 Allowed 'General case' 0 C--O 1.234 0.285 0 C-N-CA 128.312 2.645 . . . . 0.0 113.235 -169.618 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 22.5 ttpp -50.82 -43.43 58.95 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.304 1.042 . . . . 0.0 110.589 -174.9 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -64.68 -35.61 81.6 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-O 118.723 -0.656 . . . . 0.0 111.602 -177.613 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -68.79 -51.38 41.57 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 119.502 1.047 . . . . 0.0 109.43 176.063 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -57.52 -42.35 82.68 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 120.996 0.427 . . . . 0.0 109.965 -178.482 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 55.9 tt0 -55.88 -65.66 0.56 Allowed 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 123.998 0.919 . . . . 0.0 109.233 169.996 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 4.9 mt -37.66 -60.65 0.69 Allowed 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 124.864 1.265 . . . . 0.0 112.003 179.811 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 18.3 tt -61.12 -48.53 88.59 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 -176.808 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 -56.5 -50.47 71.69 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.807 0.73 . . . . 0.0 112.063 179.284 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -70.35 -50.98 33.36 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.231 0.612 . . . . 0.0 110.695 -174.123 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -96.38 -17.83 20.36 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 -167.309 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 45.3 mt . . . . . 0 CA--C 1.526 0.039 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 169.883 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 . . . . . 0 C--O 1.225 -0.227 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.93 -60.24 0.17 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 126.108 1.763 . . . . 0.0 113.909 -179.317 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -63.57 -44.19 94.82 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.553 0.741 . . . . 0.0 110.843 -174.756 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 53' ' ' ILE . . . . . 0.636 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.4 mp -62.06 -52.38 61.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 -177.916 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 75.6 t -53.86 -53.6 25.85 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 C-N-CA 123.961 0.905 . . . . 0.0 109.319 177.686 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -47.28 -52.5 16.01 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 118.698 0.681 . . . . 0.0 111.81 178.605 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 16.7 mt -50.57 -39.32 49.18 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 119.269 -0.396 . . . . 0.0 111.923 178.479 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 8.7 mmt -81.0 -64.72 1.13 Allowed 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 118.458 0.572 . . . . 0.0 109.737 178.539 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -34.82 -43.8 0.2 Allowed 'General case' 0 CA--C 1.523 -0.067 0 C-N-CA 128.046 2.538 . . . . 0.0 112.069 178.763 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -37.41 -50.95 1.1 Allowed 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.61 1.164 . . . . 0.0 112.577 176.067 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.8 pp -60.49 -33.13 72.16 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -173.987 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -83.54 -45.65 13.32 Favored 'General case' 0 N--CA 1.456 -0.125 0 C-N-CA 123.516 0.727 . . . . 0.0 109.746 176.764 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 52.8 ttt-85 -58.16 -37.14 74.11 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 122.178 -0.326 . . . . 0.0 110.955 -176.9 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 . . . . . 0 CA--C 1.537 0.458 0 O-C-N 121.478 -0.764 . . . . 0.0 112.357 177.766 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 . . . . . 0 N--CA 1.452 -0.351 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 28.4 m -79.58 136.08 24.31 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 N-CA-C 107.829 -1.175 . . . . 0.0 107.829 169.75 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 1.1 p30 -80.65 171.47 14.98 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.774 0.321 . . . . 0.0 111.186 176.682 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 55.9 t80 -38.12 -61.92 0.62 Allowed 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.401 1.08 . . . . 0.0 112.97 174.023 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 10.2 tp-100 -63.98 -32.52 74.09 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 120.391 1.45 . . . . 0.0 111.694 -175.738 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -64.52 -41.72 96.21 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 119.623 1.101 . . . . 0.0 110.162 175.15 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -57.95 -48.67 79.26 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.794 -0.566 . . . . 0.0 109.796 171.572 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 19.7 mm -60.83 -27.77 41.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 O-C-N 121.532 -0.73 . . . . 0.0 110.745 176.876 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 42.5 m -73.34 -38.69 65.67 Favored 'General case' 0 C--O 1.226 -0.181 0 O-C-N 121.076 -1.015 . . . . 0.0 110.171 172.883 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 36.6 t80 -54.33 -54.76 36.01 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 171.175 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 32.8 mt -59.9 -47.65 84.88 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 177.218 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.69 -39.83 97.93 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 111.021 -0.831 . . . . 0.0 111.021 -174.501 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.69 -47.85 57.74 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 123.882 0.873 . . . . 0.0 110.22 176.674 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -47.58 -53.74 13.72 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 123.933 0.893 . . . . 0.0 109.565 173.034 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -55.12 -56.31 21.25 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 124.259 1.024 . . . . 0.0 110.365 174.934 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 51.5 ttm -50.55 -42.95 55.96 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.516 0.598 . . . . 0.0 111.763 -178.872 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 42.8 mt -67.88 -58.39 6.24 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.442 0 CA-C-O 118.385 -0.817 . . . . 0.0 110.644 -179.627 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.364 1.0 OUTLIER -77.42 -38.39 49.79 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 119.94 1.246 . . . . 0.0 113.385 -174.674 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -78.75 64.86 3.84 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 170.295 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 60.0 mt-10 -46.91 -31.29 3.03 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 125.702 1.601 . . . . 0.0 112.802 -174.082 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -45.48 -36.92 4.79 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.06 0.944 . . . . 0.0 112.767 175.041 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 83.8 mt . . . . . 0 CA--C 1.533 0.299 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 178.267 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.192 0 CA-C-O 120.583 0.23 . . . . 0.0 111.214 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 2.7 m -54.51 161.71 1.99 Allowed Pre-proline 0 CA--C 1.538 0.518 0 C-N-CA 123.829 0.852 . . . . 0.0 111.193 173.213 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_exo -45.57 -49.08 11.08 Favored 'Trans proline' 0 N--CA 1.46 -0.453 0 C-N-CA 123.519 2.813 . . . . 0.0 113.573 -179.39 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.8 mt -55.62 -52.93 62.12 Favored 'General case' 0 C--O 1.226 -0.168 0 N-CA-C 111.769 0.285 . . . . 0.0 111.769 174.328 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -60.24 -41.44 93.14 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 -175.374 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.0 tp-100 -60.98 -51.08 70.76 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.57 0.748 . . . . 0.0 110.493 176.778 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.99 -45.81 93.31 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.338 0.655 . . . . 0.0 111.146 -178.77 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 67.2 mt -53.59 -52.16 36.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 170.518 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.69 -47.74 23.88 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 125.369 1.462 . . . . 0.0 111.601 175.718 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 mt -55.98 -54.59 42.96 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 117.726 0.763 . . . . 0.0 110.995 174.443 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.99 -43.93 91.53 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 118.87 0.759 . . . . 0.0 111.558 -179.299 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 96.2 mt -58.05 -49.29 81.9 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 123.007 0.523 . . . . 0.0 110.173 173.546 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.75 -51.54 54.4 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 110.102 -1.199 . . . . 0.0 110.102 -178.718 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 8.2 mm -54.81 -49.35 70.05 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 123.273 0.629 . . . . 0.0 109.745 175.918 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' PHE . . . . . 0.401 ' HB2' ' CE2' ' A' ' 73' ' ' TYR . 32.2 t80 -53.48 -55.67 23.36 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 121.479 0.657 . . . . 0.0 110.985 178.077 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 74.2 t60 -64.79 -32.39 74.05 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.346 -175.229 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -53.11 -49.65 66.07 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.882 0.764 . . . . 0.0 110.712 176.723 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -89.96 -36.04 15.21 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 122.323 -0.236 . . . . 0.0 111.321 -175.297 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.3 t . . . . . 0 CA--C 1.538 0.487 0 O-C-N 121.775 -0.578 . . . . 0.0 110.641 173.555 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.206 0 N-CA-C 105.694 -1.965 . . . . 0.0 105.694 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -160.01 174.82 13.78 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 119.008 0.822 . . . . 0.0 110.661 -176.79 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 59.6 p -124.57 174.38 7.86 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 118.808 0.731 . . . . 0.0 112.579 -170.025 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -27.39 -53.47 0.08 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 128.348 2.659 . . . . 0.0 114.016 169.664 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.07 -54.77 40.98 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.805 0.842 . . . . 0.0 109.713 179.724 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 -66.11 -34.34 77.83 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 118.642 -0.694 . . . . 0.0 110.527 -177.881 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 60.2 mt -65.13 -50.06 67.51 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.317 0.962 . . . . 0.0 110.999 177.946 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 40.7 mttp -57.19 -49.16 76.83 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 174.657 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -53.09 -54.73 31.26 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.644 0.778 . . . . 0.0 110.302 177.006 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.6 mt -48.42 -65.29 0.59 Allowed 'General case' 0 CA--C 1.52 -0.196 0 C-N-CA 126.099 1.759 . . . . 0.0 110.171 177.4 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 16.9 tt -59.89 -44.76 95.03 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.275 0 N-CA-C 109.543 -0.539 . . . . 0.0 109.543 -171.442 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -60.16 -53.51 56.93 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 179.364 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -67.82 -49.19 63.58 Favored 'General case' 0 C--O 1.227 -0.083 0 O-C-N 121.825 -0.547 . . . . 0.0 109.576 -174.133 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -74.63 -65.05 0.91 Allowed 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -175.767 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 89.3 mt . . . . . 0 N--CA 1.455 -0.2 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 -178.068 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 . . . . . 0 CA--C 1.531 0.213 0 N-CA-C 114.773 1.398 . . . . 0.0 114.773 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.86 -59.56 0.17 Allowed 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.796 1.639 . . . . 0.0 114.66 -178.237 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 17.6 tt0 -65.57 -40.27 92.58 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-O 121.13 0.491 . . . . 0.0 111.214 -174.265 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.643 HD12 ' H ' ' A' ' 53' ' ' ILE . 2.2 mp -63.83 -51.86 64.36 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 69.2 t -55.13 -43.7 71.34 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 C-N-CA 124.401 1.081 . . . . 0.0 110.348 178.466 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.34 -54.41 45.78 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 119.205 0.911 . . . . 0.0 110.454 173.89 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 57.5 mt -54.18 -40.02 67.15 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 119.267 -0.397 . . . . 0.0 111.2 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 25.3 mmt -68.62 -65.01 0.75 Allowed 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.549 0.613 . . . . 0.0 109.711 175.785 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -40.69 -40.46 1.31 Allowed 'General case' 0 N--CA 1.462 0.171 0 C-N-CA 128.077 2.551 . . . . 0.0 111.886 -177.572 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -38.43 -48.55 1.38 Allowed 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 124.479 1.112 . . . . 0.0 111.876 175.284 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -61.33 -38.29 86.37 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 118.393 0.542 . . . . 0.0 111.838 -176.551 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -76.15 -51.19 12.68 Favored 'General case' 0 N--CA 1.457 -0.106 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 16.9 ttm180 . . . . . 0 N--CA 1.455 -0.208 0 C-N-CA 123.571 0.748 . . . . 0.0 109.926 177.215 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 . . . . . 0 CA--C 1.53 0.186 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.4 m -137.38 149.65 25.79 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 C-N-CA 126.044 1.738 . . . . 0.0 108.079 174.331 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -89.49 175.71 7.19 Favored 'General case' 0 C--N 1.339 0.142 0 C-N-CA 124.285 1.034 . . . . 0.0 111.108 176.989 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -39.46 -64.74 0.44 Allowed 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 125.275 1.43 . . . . 0.0 112.967 174.483 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 11.0 tp-100 -65.03 -32.22 73.83 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 120.242 1.383 . . . . 0.0 111.807 -172.578 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -65.22 -44.47 88.15 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 119.033 0.833 . . . . 0.0 110.419 175.648 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' TYR . . . . . 0.401 ' CE2' ' HB2' ' A' ' 16' ' ' PHE . 0.7 OUTLIER -55.92 -54.31 46.28 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 172.279 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 20.7 mm -52.06 -46.37 42.63 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.312 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 178.419 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 92.9 m -59.35 -27.8 66.26 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 123.464 0.706 . . . . 0.0 111.795 179.084 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 11.4 t80 -59.69 -52.13 66.84 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 119.464 1.029 . . . . 0.0 108.436 172.166 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 56.2 mt -67.26 -40.05 86.15 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.853 0.861 . . . . 0.0 111.699 -179.538 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.51 -45.12 69.38 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.135 -1.186 . . . . 0.0 110.135 -178.045 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.02 -48.58 81.13 Favored 'General case' 0 N--CA 1.451 -0.387 0 O-C-N 122.279 -0.541 . . . . 0.0 109.796 173.246 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 22.5 tp -50.44 -57.03 8.97 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.407 0.622 . . . . 0.0 109.807 176.867 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.1 -55.04 16.57 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 124.56 1.144 . . . . 0.0 110.247 177.294 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 7.7 ttp -59.82 -45.07 93.53 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 122.925 0.49 . . . . 0.0 111.516 -175.908 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 93.0 mt -64.63 -52.94 48.4 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 CA-C-O 117.995 -1.002 . . . . 0.0 110.281 -177.874 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.445 0.0 OUTLIER -79.3 -34.06 42.73 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 120.034 1.288 . . . . 0.0 113.887 -176.121 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -80.1 72.93 6.92 Favored 'General case' 0 N--CA 1.462 0.164 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 169.403 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -47.79 -30.48 4.01 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.956 1.302 . . . . 0.0 113.097 -171.756 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -38.79 -47.02 1.34 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.959 1.304 . . . . 0.0 112.39 169.817 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.4 mt . . . . . 0 CA--C 1.534 0.343 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -177.241 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.277 0 CA-C-O 121.249 0.547 . . . . 0.0 110.378 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 2.5 m -59.63 166.41 3.33 Favored Pre-proline 0 CA--C 1.539 0.549 0 C-N-CA 125.134 1.374 . . . . 0.0 111.202 178.831 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_exo -45.75 -47.26 14.05 Favored 'Trans proline' 0 N--CA 1.459 -0.5 0 C-N-CA 123.257 2.638 . . . . 0.0 112.927 177.652 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.428 HD23 ' HA ' ' B' ' 5' ' ' LEU . 6.2 mt -56.67 -49.23 75.69 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 119.329 -0.367 . . . . 0.0 111.514 174.249 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -58.21 -46.74 85.31 Favored 'General case' 0 N--CA 1.457 -0.124 0 CA-C-N 118.488 0.585 . . . . 0.0 109.853 -178.402 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 -57.54 -51.0 71.25 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 122.759 0.424 . . . . 0.0 110.575 177.226 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.5 -45.7 82.55 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.49 0.716 . . . . 0.0 111.867 -175.523 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 81.7 mt -55.88 -50.08 70.97 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 172.002 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.37 -50.39 17.84 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 124.886 1.231 . . . . 0.0 111.5 173.745 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.1 mt -54.24 -57.59 10.59 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 117.474 0.637 . . . . 0.0 110.702 174.223 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 9.9 mp -57.42 -43.44 83.82 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 119.391 0.996 . . . . 0.0 112.032 -177.597 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 85.8 mt -56.97 -58.03 7.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 C-N-CA 123.171 0.588 . . . . 0.0 110.12 173.711 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.25 -49.5 67.86 Favored Glycine 0 CA--C 1.524 0.605 0 N-CA-C 110.553 -1.019 . . . . 0.0 110.553 -175.269 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.3 mm -49.68 -50.99 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 C-N-CA 124.139 0.976 . . . . 0.0 109.935 173.749 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 56.4 t80 -57.46 -58.94 6.1 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 121.042 0.449 . . . . 0.0 110.008 178.05 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 7.1 t-80 -51.55 -36.98 47.43 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.051 0.94 . . . . 0.0 111.626 -176.513 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -51.56 -34.04 34.97 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.298 1.039 . . . . 0.0 112.474 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -111.61 -47.41 3.16 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 118.6 0.636 . . . . 0.0 110.688 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.455 -0.203 0 C-N-CA 123.266 0.626 . . . . 0.0 111.963 -176.398 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.539 0.536 0 N-CA-C 114.109 1.152 . . . . 0.0 114.109 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -138.85 151.91 47.38 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.078 1.351 . . . . 0.0 109.474 -170.201 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -156.09 166.38 33.62 Favored 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 123.26 0.624 . . . . 0.0 110.779 174.031 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 67.9 m -111.76 174.68 5.76 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.145 1.378 . . . . 0.0 112.818 -176.197 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -37.81 -55.38 1.19 Allowed 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 126.913 2.085 . . . . 0.0 114.545 -177.683 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -53.56 -48.51 69.08 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 -176.725 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -61.14 -38.65 87.16 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 123.041 0.536 . . . . 0.0 111.324 179.133 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 85.0 mt -63.27 -49.33 74.48 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 119.214 0.916 . . . . 0.0 111.038 175.722 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -57.56 -47.17 82.79 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 177.882 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -58.17 -47.41 83.49 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-O 119.024 -0.512 . . . . 0.0 110.791 175.232 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 8.9 mt -50.76 -53.58 30.56 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 119.655 1.116 . . . . 0.0 110.176 178.242 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 35.9 mt -56.78 -60.34 2.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.212 175.558 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 21.1 tt0 -53.07 -48.98 67.3 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.621 -0.674 . . . . 0.0 112.496 -173.476 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 9.5 mmpt? -79.53 -48.97 12.96 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 125.564 1.546 . . . . 0.0 110.551 -171.178 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 28.2 mm-40 -101.89 -12.42 18.26 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 -168.435 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 57.2 mt . . . . . 0 C--O 1.231 0.102 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 169.559 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 18.3 p-10 . . . . . 0 N--CA 1.463 0.189 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.84 -63.57 0.13 Allowed 'General case' 0 C--O 1.226 -0.142 0 C-N-CA 126.198 1.799 . . . . 0.0 114.133 -174.242 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -66.17 -37.54 85.89 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 122.747 0.419 . . . . 0.0 111.32 -172.719 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 53' ' ' ILE . . . . . 0.634 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.4 mp -62.28 -52.76 56.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 N-CA-C 106.076 -1.824 . . . . 0.0 106.076 177.841 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 71.9 t -54.04 -40.87 47.68 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 C-N-CA 124.23 1.012 . . . . 0.0 110.41 176.912 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 12.8 mmmt -60.94 -51.22 70.21 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 120.187 1.358 . . . . 0.0 110.484 175.915 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 76.3 mt -56.96 -36.41 70.26 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 119.148 -0.454 . . . . 0.0 110.906 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 25.2 mmt -70.26 -62.49 1.37 Allowed 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 118.739 0.699 . . . . 0.0 109.808 173.918 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -46.61 -30.47 2.31 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 128.132 2.573 . . . . 0.0 112.405 -176.936 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -38.29 -48.17 1.28 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.508 1.123 . . . . 0.0 111.268 169.181 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.9 pp -58.52 -34.32 70.83 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 121.144 -0.972 . . . . 0.0 112.167 -178.764 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -78.42 -55.95 4.82 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 178.866 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 16.5 mmt180 -42.11 -50.35 4.75 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 124.972 1.309 . . . . 0.0 110.646 176.371 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 25.5 m120 . . . . . 0 N--CA 1.449 -0.485 0 C-N-CA 123.971 0.908 . . . . 0.0 111.849 -171.456 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 . . . . . 0 N--CA 1.452 -0.348 0 CA-C-O 120.643 0.259 . . . . 0.0 111.309 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 34.9 m -132.58 147.6 31.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 N-CA-C 105.618 -1.993 . . . . 0.0 105.618 165.713 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 20.2 p30 -89.24 171.6 9.67 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 123.556 0.742 . . . . 0.0 110.884 176.746 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -39.97 -60.85 0.95 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.568 1.147 . . . . 0.0 113.16 175.186 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -64.56 -35.99 82.78 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 120.314 1.416 . . . . 0.0 111.362 -174.167 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.77 -40.27 96.27 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.561 -0.712 . . . . 0.0 110.578 175.194 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -57.2 -49.68 75.25 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 118.571 0.623 . . . . 0.0 109.964 169.653 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 24.6 mm -58.62 -28.14 36.05 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 O-C-N 121.384 -0.822 . . . . 0.0 110.709 176.779 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 30.1 m -80.25 -23.48 40.79 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.231 1.012 . . . . 0.0 111.786 173.366 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -67.56 -53.48 28.0 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 107.673 -1.232 . . . . 0.0 107.673 169.946 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 40.9 mt -57.65 -41.65 81.91 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 120.908 0.385 . . . . 0.0 110.668 171.661 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.76 -53.1 46.53 Favored Glycine 0 CA--C 1.523 0.577 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 179.329 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.75 -47.31 85.8 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 122.83 0.452 . . . . 0.0 110.641 178.218 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 11.3 tp -48.06 -60.54 2.54 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.978 0.894 . . . . 0.0 110.082 175.155 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.85 -56.64 12.78 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 125.31 1.444 . . . . 0.0 110.294 -179.825 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 56.6 ttm -56.26 -43.42 78.71 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.737 0.815 . . . . 0.0 110.989 -178.321 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 96.4 mt -67.9 -55.74 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-O 118.415 -0.802 . . . . 0.0 109.533 -175.613 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.4 0.4 OUTLIER -73.13 -33.63 65.64 Favored 'General case' 0 C--N 1.344 0.356 0 C-N-CA 118.325 -1.35 . . . . 0.0 112.803 -175.982 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -81.14 64.98 6.1 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 169.071 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -42.22 -37.96 1.63 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.138 1.375 . . . . 0.0 112.747 -176.861 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.69 -54.0 0.44 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 126.093 1.757 . . . . 0.0 112.65 169.649 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 61.7 mt . . . . . 0 CA--C 1.532 0.284 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -173.285 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.137 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.4 m -56.01 163.79 2.07 Favored Pre-proline 0 CA--C 1.54 0.593 0 C-N-CA 124.204 1.002 . . . . 0.0 111.352 177.049 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -46.62 -49.02 12.71 Favored 'Trans proline' 0 N--CA 1.459 -0.528 0 C-N-CA 123.255 2.637 . . . . 0.0 112.831 178.962 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.2 mt -58.64 -46.39 87.22 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-O 119.193 -0.432 . . . . 0.0 111.543 175.891 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -56.97 -48.18 79.0 Favored 'General case' 0 C--O 1.227 -0.131 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 -179.025 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.3 tp60 -62.81 -44.44 96.14 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.275 179.146 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.4 -46.17 81.08 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 121.355 0.598 . . . . 0.0 111.328 -178.181 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 72.4 mt -54.55 -50.86 55.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 170.532 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.51 -48.98 16.48 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 124.646 1.117 . . . . 0.0 111.729 173.983 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 mt -55.36 -55.34 32.71 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 117.767 0.784 . . . . 0.0 110.945 174.409 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -58.91 -45.2 90.9 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 119.012 0.824 . . . . 0.0 111.839 -178.04 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.415 HD11 ' HB1' ' B' ' 81' ' ' ALA . 90.5 mt -59.5 -50.98 77.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 C-N-CA 122.857 0.463 . . . . 0.0 110.354 175.073 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -53.59 -54.07 32.3 Favored Glycine 0 CA--C 1.523 0.539 0 N-CA-C 109.763 -1.335 . . . . 0.0 109.763 -179.409 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 6.8 mm -50.53 -51.7 18.24 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 C-N-CA 124.079 0.952 . . . . 0.0 110.12 174.959 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -51.51 -57.25 9.57 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 118.022 0.374 . . . . 0.0 110.594 178.454 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -70.3 -21.7 62.91 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 -174.756 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.8 ttpp -57.93 -18.57 24.09 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 119.034 -0.508 . . . . 0.0 111.342 169.701 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -115.92 -67.72 0.97 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.743 0.817 . . . . 0.0 110.273 171.565 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 30.9 p . . . . . 0 N--CA 1.469 0.476 0 CA-C-O 121.714 0.769 . . . . 0.0 111.158 -173.997 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.3 p . . . . . 0 N--CA 1.449 -0.478 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.7 pp -160.2 -173.86 4.24 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 169.384 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 77.8 p -129.95 172.84 11.28 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 119.697 1.135 . . . . 0.0 112.568 -179.582 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.7 ptmm? -31.69 -51.06 0.21 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 126.107 1.763 . . . . 0.0 113.512 169.491 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.7 ttpt -60.87 -47.53 85.98 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -177.241 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.0 mp0 -66.55 -35.44 80.23 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 118.428 -0.796 . . . . 0.0 110.559 179.804 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 73.7 mt -61.52 -51.38 68.85 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.779 1.172 . . . . 0.0 111.032 174.621 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.0 mtpp -60.11 -45.12 94.03 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 120.841 0.353 . . . . 0.0 110.279 179.545 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -54.52 -54.93 34.58 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.112 0.965 . . . . 0.0 110.521 173.661 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.0 mt -49.02 -61.19 2.2 Favored 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 125.382 1.473 . . . . 0.0 110.033 178.952 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 20.2 tt -59.71 -48.74 86.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 C-N-CA 119.872 -0.731 . . . . 0.0 109.724 -176.377 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 -54.88 -50.11 69.54 Favored 'General case' 0 CA--C 1.539 0.528 0 O-C-N 121.88 -0.512 . . . . 0.0 112.208 -178.579 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.7 -54.21 7.32 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 121.908 -0.495 . . . . 0.0 110.714 -176.862 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 49.8 mm-40 -82.4 -21.81 35.64 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 -167.382 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 23.0 mt . . . . . 0 C--O 1.227 -0.086 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 174.437 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 . . . . . 0 N--CA 1.462 0.135 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.37 -60.91 0.14 Allowed 'General case' 0 C--O 1.226 -0.177 0 C-N-CA 125.874 1.67 . . . . 0.0 113.313 -176.331 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -64.56 -38.09 89.82 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -173.316 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.479 HD12 ' H ' ' A' ' 53' ' ' ILE . 1.2 mp -61.64 -54.97 27.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 N-CA-C 106.159 -1.793 . . . . 0.0 106.159 176.519 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 79.1 t -51.49 -49.62 32.22 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.079 -178.298 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 6.4 mmmm -51.86 -47.61 64.37 Favored 'General case' 0 C--N 1.339 0.111 0 CA-C-N 119.59 1.086 . . . . 0.0 111.753 -176.567 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 32.9 mt -57.33 -35.61 70.1 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 119.283 -0.389 . . . . 0.0 111.543 -178.011 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.28 -62.87 1.55 Allowed 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 176.128 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -40.57 -40.36 1.24 Allowed 'General case' 0 CA--C 1.523 -0.094 0 C-N-CA 127.528 2.331 . . . . 0.0 111.877 -179.351 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -38.52 -47.57 1.3 Allowed 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.811 1.244 . . . . 0.0 112.009 175.715 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -57.6 -51.89 67.65 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 118.124 0.42 . . . . 0.0 110.713 -178.44 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -74.44 -31.38 62.26 Favored 'General case' 0 C--O 1.224 -0.262 0 C-N-CA 123.231 0.613 . . . . 0.0 111.383 -176.215 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.5 ttm180 . . . . . 0 N--CA 1.452 -0.369 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 173.315 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 . . . . . 0 CA--C 1.533 0.315 0 CA-C-O 120.822 0.344 . . . . 0.0 110.735 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 4.2 m -143.93 159.79 16.03 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 127.218 2.207 . . . . 0.0 107.87 174.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -101.04 170.92 7.95 Favored 'General case' 0 N--CA 1.462 0.157 0 C-N-CA 125.086 1.354 . . . . 0.0 110.964 175.812 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 73.9 t80 -35.12 -63.42 0.33 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.685 1.194 . . . . 0.0 112.945 171.859 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 28.9 tp60 -67.03 -29.04 68.74 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 119.633 1.106 . . . . 0.0 111.81 -171.939 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -65.72 -43.23 89.73 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.14 -0.975 . . . . 0.0 109.845 172.671 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -54.43 -49.29 70.33 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.985 -0.447 . . . . 0.0 109.91 170.611 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.8 mm -58.72 -33.53 49.29 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 O-C-N 121.6 -0.688 . . . . 0.0 110.732 175.648 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 32.3 m -70.52 -30.27 66.99 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.07 -1.019 . . . . 0.0 111.04 174.565 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -61.03 -55.45 32.65 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 121.096 -1.003 . . . . 0.0 109.169 170.899 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 44.3 mt -62.36 -40.25 95.8 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.118 0.485 . . . . 0.0 111.535 179.19 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.35 -43.69 96.49 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 110.643 -0.983 . . . . 0.0 110.643 179.617 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.39 -47.8 80.5 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 117.497 0.648 . . . . 0.0 110.444 175.628 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 20.3 tp -48.61 -58.98 3.89 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 121.402 0.62 . . . . 0.0 110.257 172.731 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ALA . . . . . 0.516 ' HB1' HD11 ' B' ' 13' ' ' ILE . . . -49.77 -54.18 20.58 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 124.381 1.073 . . . . 0.0 110.496 179.328 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 46.9 ttm -57.84 -49.78 75.51 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 123.809 0.844 . . . . 0.0 111.091 -178.316 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 67.0 mt -63.35 -49.56 82.37 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 CA-C-O 117.942 -1.028 . . . . 0.0 109.932 -174.13 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.451 0.1 OUTLIER -79.46 -37.66 36.4 Favored 'General case' 0 C--N 1.347 0.488 0 CA-C-N 119.733 1.151 . . . . 0.0 113.837 -178.258 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -80.72 75.12 7.64 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 107.691 -1.225 . . . . 0.0 107.691 171.043 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -47.66 -32.45 5.67 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.627 1.171 . . . . 0.0 112.684 -175.903 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -40.87 -38.87 1.02 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.673 1.189 . . . . 0.0 113.171 171.654 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 43.7 mt . . . . . 0 CA--C 1.537 0.462 0 C-N-CA 124.939 1.296 . . . . 0.0 113.828 -173.828 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.247 0 CA-C-O 120.902 0.382 . . . . 0.0 110.101 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -53.83 159.99 2.38 Favored Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 124.622 1.169 . . . . 0.0 111.248 176.74 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -47.52 -49.62 12.94 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 123.305 2.67 . . . . 0.0 112.806 179.801 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.43 HD23 ' HA ' ' B' ' 5' ' ' LEU . 5.2 mt -58.41 -43.88 88.79 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 119.094 -0.479 . . . . 0.0 111.788 174.873 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -62.86 -42.06 99.61 Favored 'General case' 0 C--O 1.226 -0.143 0 CA-C-N 119.045 0.838 . . . . 0.0 109.489 -177.666 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 12.8 tp60 -61.69 -46.75 88.37 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 122.39 0.276 . . . . 0.0 110.853 175.109 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.28 -46.8 82.09 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.645 0.736 . . . . 0.0 111.275 -177.585 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 74.8 mt -55.74 -50.92 64.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 171.492 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -48.49 -45.89 29.43 Favored Glycine 0 CA--C 1.527 0.787 0 C-N-CA 125.031 1.301 . . . . 0.0 111.468 175.372 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.8 mt -56.27 -57.45 12.18 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 117.613 0.707 . . . . 0.0 110.409 173.284 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -57.12 -43.4 82.32 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 119.371 0.987 . . . . 0.0 112.122 -178.225 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 13' ' ' ILE . . . . . 0.516 HD11 ' HB1' ' A' ' 81' ' ' ALA . 97.2 mt -61.2 -54.08 40.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 123.151 0.58 . . . . 0.0 110.679 175.495 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.99 -51.23 55.16 Favored Glycine 0 CA--C 1.522 0.494 0 N-CA-C 109.666 -1.374 . . . . 0.0 109.666 -177.739 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 8.5 mm -48.04 -54.7 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 C-N-CA 124.279 1.032 . . . . 0.0 110.277 173.03 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -53.29 -62.15 1.84 Allowed 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 121.347 0.594 . . . . 0.0 110.257 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 54.7 t60 -72.63 -12.91 61.24 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 118.971 -0.538 . . . . 0.0 112.393 -170.812 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -54.96 -44.48 74.4 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.423 1.01 . . . . 0.0 108.778 169.093 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -94.15 73.07 3.99 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 104.9 -2.259 . . . . 0.0 104.9 171.122 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 85.1 p . . . . . 0 CA--C 1.531 0.225 0 C-N-CA 127.227 2.211 . . . . 0.0 114.376 -167.678 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 6.4 p-80 . . . . . 0 CA--C 1.54 0.578 0 N-CA-C 111.58 0.215 . . . . 0.0 111.58 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 71.6 p -134.43 145.03 48.5 Favored 'General case' 0 C--O 1.227 -0.089 0 C-N-CA 124.921 1.288 . . . . 0.0 108.246 175.643 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -156.57 163.03 39.84 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-N 119.323 0.965 . . . . 0.0 110.69 -178.092 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 29.9 t -120.99 -168.65 1.7 Allowed 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.635 0.731 . . . . 0.0 110.944 -176.197 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 10.3 pttm -46.99 -50.98 18.22 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 126.893 2.077 . . . . 0.0 113.131 -171.128 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -55.48 -52.13 64.66 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 120.762 0.315 . . . . 0.0 110.294 -179.132 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -67.04 -35.66 80.37 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 118.436 -0.792 . . . . 0.0 111.8 -179.456 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 30.0 mt -64.03 -52.3 60.14 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 119.966 1.257 . . . . 0.0 111.149 175.145 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 90.4 mttt -56.38 -43.83 79.6 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 122.707 0.403 . . . . 0.0 110.044 177.317 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 65.7 tt0 -54.09 -66.45 0.39 Allowed 'General case' 0 C--O 1.223 -0.334 0 CA-C-O 118.895 -0.574 . . . . 0.0 109.523 171.448 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 3.8 mt -37.54 -60.09 0.72 Allowed 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 125.364 1.465 . . . . 0.0 111.565 179.53 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 14.3 tt -62.55 -45.2 99.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.265 -176.094 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 -57.34 -52.96 63.22 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 121.343 -0.848 . . . . 0.0 111.731 177.648 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 11.4 mmpt? -66.76 -49.29 66.4 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.059 0.544 . . . . 0.0 110.497 -174.562 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 70.1 mm-40 -98.06 -16.65 19.51 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 115.06 1.504 . . . . 0.0 115.06 -166.77 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 13.5 mt . . . . . 0 CA--C 1.523 -0.088 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 171.894 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 . . . . . 0 C--O 1.225 -0.222 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.64 -56.25 0.16 Allowed 'General case' 0 CA--C 1.527 0.092 0 C-N-CA 126.118 1.767 . . . . 0.0 114.455 -177.587 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -67.45 -39.54 85.37 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 120.912 0.387 . . . . 0.0 111.148 -174.436 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 53' ' ' ILE . . . . . 0.56 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.5 mp -61.68 -51.4 73.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 176.807 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 76.9 t -57.34 -42.4 80.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 C-N-CA 123.938 0.895 . . . . 0.0 110.475 -179.417 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.76 -55.21 37.79 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 119.433 1.015 . . . . 0.0 110.443 173.089 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 49.0 mt -53.35 -37.96 62.84 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 122.489 0.316 . . . . 0.0 111.544 -179.55 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.72 -65.56 0.81 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.236 0.471 . . . . 0.0 109.961 175.721 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -40.32 -39.88 1.05 Allowed 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 127.489 2.316 . . . . 0.0 111.991 -177.95 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -37.04 -51.34 0.94 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.172 1.389 . . . . 0.0 111.816 172.923 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -58.75 -35.64 73.05 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 121.43 -0.794 . . . . 0.0 112.232 -176.591 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -80.75 -49.57 10.98 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 123.141 0.577 . . . . 0.0 109.629 179.385 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 14.8 ttm180 -50.89 -46.72 60.64 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.617 0.767 . . . . 0.0 110.164 178.901 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 34.6 m120 . . . . . 0 N--CA 1.455 -0.214 0 C-N-CA 123.257 0.623 . . . . 0.0 112.37 -179.104 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 50.0 mm-40 . . . . . 0 N--CA 1.45 -0.473 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 32.7 m -87.13 148.52 4.56 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 N-CA-C 107.483 -1.302 . . . . 0.0 107.483 167.308 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 15.5 p-10 -91.18 -176.68 4.66 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 123.94 0.896 . . . . 0.0 111.403 177.341 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -49.84 -62.09 1.76 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.853 0.861 . . . . 0.0 112.293 177.256 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 41.1 tp60 -60.4 -37.25 80.23 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 119.299 0.954 . . . . 0.0 111.17 -174.064 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -62.66 -46.07 89.9 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.711 -0.618 . . . . 0.0 110.705 175.753 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -55.15 -49.81 70.89 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.846 -0.534 . . . . 0.0 110.148 171.59 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 26.8 mm -56.98 -28.48 28.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 O-C-N 121.799 -0.563 . . . . 0.0 110.464 175.425 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 27.8 m -80.96 -24.48 38.07 Favored 'General case' 0 CA--C 1.529 0.171 0 O-C-N 121.301 -0.874 . . . . 0.0 112.986 173.459 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -62.9 -52.74 61.9 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 107.117 -1.438 . . . . 0.0 107.117 167.909 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 48.9 mt -62.22 -40.9 97.65 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 120.888 0.375 . . . . 0.0 111.726 175.295 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -60.82 -49.53 77.58 Favored Glycine 0 CA--C 1.521 0.428 0 N-CA-C 110.53 -1.028 . . . . 0.0 110.53 -179.128 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.49 -47.44 85.66 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.155 0.582 . . . . 0.0 110.026 175.801 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 19.5 tp -49.59 -57.22 7.54 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.455 0.645 . . . . 0.0 109.853 175.968 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 81' ' ' ALA . . . . . 0.415 ' HB1' HD11 ' A' ' 13' ' ' ILE . . . -51.64 -56.47 13.41 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 124.71 1.204 . . . . 0.0 110.55 178.724 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 55.5 ttm -54.56 -46.97 73.75 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.172 0.989 . . . . 0.0 111.177 -178.86 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.1 mt -66.52 -52.86 41.57 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.301 0 CA-C-O 117.922 -1.037 . . . . 0.0 110.399 -175.145 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.436 0.0 OUTLIER -80.46 -33.59 36.59 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 120.027 1.285 . . . . 0.0 114.141 -176.611 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 22.6 m-80 -81.33 70.03 8.09 Favored 'General case' 0 CA--C 1.523 -0.088 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 170.166 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -42.82 -38.25 2.08 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 126.024 1.73 . . . . 0.0 111.699 -176.134 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -34.02 -47.68 0.28 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 126.551 1.94 . . . . 0.0 113.343 170.62 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 64.5 mt . . . . . 0 CA--C 1.531 0.23 0 C-N-CA 123.126 0.571 . . . . 0.0 112.443 -177.382 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.223 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.1 m -51.84 158.19 1.75 Allowed Pre-proline 0 CA--C 1.54 0.558 0 C-N-CA 124.149 0.98 . . . . 0.0 110.802 171.688 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -48.47 -48.9 15.81 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 122.944 2.429 . . . . 0.0 112.752 -179.196 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.9 mt -59.95 -44.91 94.11 Favored 'General case' 0 C--O 1.224 -0.251 0 CA-C-O 119.299 -0.381 . . . . 0.0 111.328 175.522 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -58.89 -46.82 86.94 Favored 'General case' 0 CA--C 1.528 0.12 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 -178.143 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -57.68 -52.4 65.58 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.383 0.673 . . . . 0.0 110.743 175.76 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.95 -46.2 88.88 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.407 0.622 . . . . 0.0 111.783 -175.669 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 71.2 mt -54.65 -51.88 46.69 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 171.282 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.55 -48.31 17.06 Favored Glycine 0 CA--C 1.527 0.814 0 C-N-CA 124.725 1.155 . . . . 0.0 111.804 174.804 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 mt -55.74 -56.42 20.65 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 117.613 0.706 . . . . 0.0 111.078 174.365 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 mp -58.3 -44.15 88.43 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 118.979 0.809 . . . . 0.0 111.696 -178.362 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 83.3 mt -55.81 -55.14 19.43 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.185 0 C-N-CA 123.316 0.646 . . . . 0.0 109.975 173.283 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.06 -50.03 56.89 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 110.541 -1.024 . . . . 0.0 110.541 -177.563 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 11.7 mm -53.03 -49.2 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 C-N-CA 123.371 0.668 . . . . 0.0 110.271 175.776 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -56.4 -62.96 1.36 Allowed 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 121.293 0.568 . . . . 0.0 109.622 177.05 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -51.82 -39.68 59.19 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.8 1.24 . . . . 0.0 111.689 -174.049 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.5 tttp -48.97 -39.42 26.49 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.079 0.951 . . . . 0.0 111.441 178.01 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -100.01 -59.85 1.64 Allowed 'General case' 0 C--O 1.234 0.261 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.6 m . . . . . 0 N--CA 1.453 -0.281 0 C-N-CA 124.049 0.94 . . . . 0.0 111.117 -175.662 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 60.3 p . . . . . 0 CA--C 1.538 0.484 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -145.64 168.84 19.69 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 123.236 0.614 . . . . 0.0 110.531 176.017 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 72.8 m -111.1 177.05 4.78 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.187 1.395 . . . . 0.0 113.73 -174.148 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.5 ptpt -41.92 -53.7 3.72 Favored 'General case' 0 C--N 1.339 0.146 0 C-N-CA 126.602 1.961 . . . . 0.0 114.594 -176.46 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 23.5 ttmm -54.75 -50.09 69.26 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 -177.629 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -58.56 -44.14 89.61 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-O 118.693 -0.67 . . . . 0.0 111.098 177.515 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 90.0 mt -59.02 -51.2 71.09 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 119.17 0.896 . . . . 0.0 111.52 176.747 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 54.5 mtmt -59.01 -47.66 84.39 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 -179.022 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.3 -54.15 48.84 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-O 119.28 -0.39 . . . . 0.0 110.836 174.105 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.6 mt -44.77 -64.4 0.71 Allowed 'General case' 0 CA--C 1.522 -0.109 0 C-N-CA 124.25 1.02 . . . . 0.0 110.425 177.771 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 18.3 tt -60.24 -49.62 83.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 120.174 -0.61 . . . . 0.0 109.989 -175.28 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -55.93 -49.2 74.16 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.579 0.752 . . . . 0.0 112.332 -176.884 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.46 -54.4 7.09 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 -176.946 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -73.8 -29.98 62.47 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 118.302 -0.856 . . . . 0.0 112.72 -168.322 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 59.7 mt . . . . . 0 C--N 1.339 0.126 0 N-CA-C 107.221 -1.399 . . . . 0.0 107.221 167.847 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.8 t70 . . . . . 0 C--O 1.227 -0.128 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -38.54 -61.47 0.7 Allowed 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 125.035 1.334 . . . . 0.0 112.938 -176.692 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 58.6 tt0 -61.22 -37.82 84.39 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.047 0.539 . . . . 0.0 110.89 -175.936 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.501 ' H ' ' CD1' ' A' ' 53' ' ' ILE . 0.9 OUTLIER -62.55 -54.18 37.33 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 N-CA-C 105.974 -1.862 . . . . 0.0 105.974 -178.926 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 59.9 t -54.94 -39.76 50.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 CA-C-O 118.118 -0.944 . . . . 0.0 110.702 176.844 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 12.6 mmmt -59.96 -51.53 69.27 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 120.226 1.376 . . . . 0.0 110.414 176.292 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 85.1 mt -57.34 -37.6 72.8 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 119.322 -0.371 . . . . 0.0 110.828 -179.474 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 24.0 mmt -70.34 -62.85 1.23 Allowed 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 118.59 0.632 . . . . 0.0 109.992 175.503 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -44.29 -42.47 6.71 Favored 'General case' 0 CA--C 1.52 -0.19 0 C-N-CA 127.472 2.309 . . . . 0.0 111.425 -176.823 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -38.0 -50.87 1.36 Allowed 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.087 1.355 . . . . 0.0 111.391 174.178 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 71.1 mt -60.54 -35.78 76.85 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 121.924 -0.485 . . . . 0.0 111.667 -175.514 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -80.81 -54.76 5.32 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.437 0.695 . . . . 0.0 109.824 179.716 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 14.7 ttm180 . . . . . 0 N--CA 1.455 -0.178 0 C-N-CA 124.473 1.109 . . . . 0.0 110.044 177.741 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 . . . . . 0 N--CA 1.454 -0.262 0 CA-C-O 120.877 0.37 . . . . 0.0 111.587 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 23.4 m -130.86 147.2 33.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 N-CA-C 105.65 -1.981 . . . . 0.0 105.65 166.641 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -88.53 168.29 12.71 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 122.719 0.408 . . . . 0.0 111.194 175.832 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -33.45 -61.55 0.31 Allowed 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.722 1.209 . . . . 0.0 112.854 171.818 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 38.6 tp60 -61.92 -33.27 73.94 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 119.794 1.179 . . . . 0.0 112.042 -174.673 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -70.18 -40.01 74.92 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.249 -0.907 . . . . 0.0 110.095 177.076 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -56.92 -48.5 78.11 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 169.967 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ILE . . . . . 0.403 ' CG2' ' CG2' ' B' ' 74' ' ' ILE . 27.3 mm -58.23 -36.64 58.62 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.255 0 O-C-N 121.535 -0.728 . . . . 0.0 110.006 175.701 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 42.5 m -64.35 -38.54 91.4 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.931 0.787 . . . . 0.0 110.489 174.645 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -55.88 -55.41 32.89 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 172.677 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 36.3 mt -59.37 -41.98 90.58 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.987 -0.445 . . . . 0.0 112.133 178.262 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.38 -39.96 87.21 Favored Glycine 0 CA--C 1.523 0.593 0 N-CA-C 110.638 -0.985 . . . . 0.0 110.638 -175.583 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.01 -50.03 67.87 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 117.597 0.699 . . . . 0.0 109.938 173.758 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -47.92 -56.84 6.64 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 123.988 0.915 . . . . 0.0 110.05 175.256 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.86 -62.5 1.57 Allowed 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 124.677 1.191 . . . . 0.0 110.327 175.081 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 6.5 ttp -54.92 -37.94 67.02 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.121 0.569 . . . . 0.0 112.039 -173.857 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 73.6 mt -69.82 -57.84 7.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 CA-C-O 117.975 -1.012 . . . . 0.0 110.877 178.083 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.438 0.2 OUTLIER -77.76 -35.14 52.05 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 120.313 1.415 . . . . 0.0 113.814 -174.208 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.3 m120 -80.55 58.79 3.32 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 106.425 -1.694 . . . . 0.0 106.425 168.535 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -47.09 -35.22 6.74 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 126.769 2.028 . . . . 0.0 113.505 -167.872 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -43.12 -36.95 1.85 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.706 1.203 . . . . 0.0 112.953 175.043 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 34.0 mt . . . . . 0 CA--C 1.529 0.165 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 178.011 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.293 0 CA-C-O 120.881 0.372 . . . . 0.0 110.189 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.09 165.55 1.39 Allowed Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 125.53 1.532 . . . . 0.0 111.756 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo -46.14 -50.77 9.5 Favored 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 123.528 2.819 . . . . 0.0 113.052 177.908 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 5' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' B' ' 5' ' ' LEU . 6.0 mt -55.9 -52.51 63.85 Favored 'General case' 0 C--N 1.34 0.175 0 O-C-N 122.328 -0.233 . . . . 0.0 111.115 175.109 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -58.78 -43.59 90.49 Favored 'General case' 0 C--O 1.225 -0.201 0 N-CA-C 110.118 -0.326 . . . . 0.0 110.118 -175.217 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 tp-100 -61.94 -49.72 75.0 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.147 0.979 . . . . 0.0 110.441 177.534 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.87 -44.2 96.74 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.039 0.536 . . . . 0.0 111.222 -178.192 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 71.3 mt -54.4 -53.31 31.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 169.917 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -44.97 -48.25 9.45 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 124.947 1.261 . . . . 0.0 111.923 174.436 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 mt -56.61 -57.93 10.24 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 117.679 0.739 . . . . 0.0 110.895 174.199 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.0 mp -56.41 -42.77 78.54 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 119.483 1.038 . . . . 0.0 111.75 -178.35 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 71.6 mt -59.3 -55.25 24.87 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 C-N-CA 123.508 0.723 . . . . 0.0 110.779 174.697 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.91 -48.99 69.12 Favored Glycine 0 CA--C 1.523 0.549 0 N-CA-C 110.198 -1.161 . . . . 0.0 110.198 -177.854 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 9.5 mm -51.25 -49.81 28.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 C-N-CA 124.34 1.056 . . . . 0.0 110.103 173.687 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -56.18 -61.64 2.26 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.082 0.468 . . . . 0.0 109.772 177.509 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 13.5 m-70 -53.0 -37.09 61.16 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.936 0.894 . . . . 0.0 112.812 -176.679 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 62.3 tttm -47.12 -35.67 7.45 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.904 0.881 . . . . 0.0 111.368 175.862 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -102.95 -66.99 0.9 Allowed 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 173.804 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.227 -0.111 0 C-N-CA 123.899 0.88 . . . . 0.0 112.152 -170.726 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 13.9 t-160 . . . . . 0 CA--C 1.536 0.44 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 45.4 p -140.07 148.75 42.22 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.329 1.052 . . . . 0.0 113.804 -168.1 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -151.61 173.44 14.65 Favored 'General case' 0 CA--C 1.527 0.067 0 C-N-CA 123.263 0.625 . . . . 0.0 110.03 171.471 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 22.2 p -117.67 174.24 6.28 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 124.495 1.118 . . . . 0.0 113.318 -169.539 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 6.6 pttp -34.79 -59.77 0.47 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 126.867 2.067 . . . . 0.0 112.986 175.723 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 35.3 tptt -44.87 -49.51 10.87 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 124.558 1.143 . . . . 0.0 111.797 176.597 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -70.34 -36.0 73.94 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 122.902 0.481 . . . . 0.0 110.632 -176.329 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 34.6 mt -64.33 -46.66 82.54 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.647 0.658 . . . . 0.0 110.789 174.673 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -55.6 -51.87 65.7 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 174.869 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 68.3 mt-10 -56.51 -47.43 79.36 Favored 'General case' 0 C--O 1.218 -0.56 0 CA-C-O 118.969 -0.539 . . . . 0.0 110.856 176.073 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 8.5 mt -51.0 -53.22 35.23 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 119.574 1.079 . . . . 0.0 110.464 179.339 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 1.4 mp -56.09 -58.61 4.51 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 174.597 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -55.23 -43.93 75.01 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -172.254 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 6.9 mmpt? -83.11 -54.59 4.93 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 125.667 1.587 . . . . 0.0 109.916 -172.662 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 44.7 mm-40 -94.42 -17.26 22.68 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 -167.798 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 67.4 mt . . . . . 0 N--CA 1.457 -0.082 0 C-N-CA 123.907 0.883 . . . . 0.0 108.997 170.793 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 . . . . . 0 C--O 1.226 -0.142 0 N-CA-C 113.523 0.935 . . . . 0.0 113.523 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.49 -60.31 0.15 Allowed 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 126.076 1.75 . . . . 0.0 113.344 -179.195 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -69.75 -36.84 76.15 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 122.248 0.219 . . . . 0.0 111.194 -172.929 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 53' ' ' ILE . . . . . 0.517 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.3 mp -62.86 -55.3 24.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 178.455 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 78.3 t -55.84 -46.01 79.9 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 C-N-CA 124.709 1.204 . . . . 0.0 110.015 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -53.6 -53.47 51.28 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 118.216 0.462 . . . . 0.0 110.791 173.912 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 68.7 mt -56.53 -43.86 80.26 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 119.116 -0.468 . . . . 0.0 111.452 178.81 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 25.7 mmt -62.42 -59.27 5.22 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 118.816 0.734 . . . . 0.0 109.393 178.765 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -54.22 -40.76 67.97 Favored 'General case' 0 N--CA 1.457 -0.112 0 C-N-CA 125.303 1.441 . . . . 0.0 111.007 -175.397 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -38.93 -50.97 1.78 Allowed 'General case' 0 C--O 1.232 0.158 0 C-N-CA 125.747 1.619 . . . . 0.0 112.555 -173.794 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 3.0 pp -58.86 -39.26 80.81 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 -176.127 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -77.0 -45.7 26.42 Favored 'General case' 0 N--CA 1.456 -0.157 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 177.51 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 23.4 ttm-85 -48.93 -44.53 40.55 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.532 0.733 . . . . 0.0 109.979 179.086 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 . . . . . 0 CA--C 1.532 0.284 0 C-N-CA 123.1 0.56 . . . . 0.0 111.86 179.561 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 . . . . . 0 N--CA 1.455 -0.209 0 CA-C-O 121.213 0.53 . . . . 0.0 111.818 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 36.0 m -124.9 152.39 31.19 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 C-N-CA 126.607 1.963 . . . . 0.0 106.081 167.743 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 10.6 p30 -91.5 169.23 10.94 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 123.156 0.582 . . . . 0.0 110.54 175.389 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -35.58 -60.67 0.5 Allowed 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 125.125 1.37 . . . . 0.0 113.243 177.019 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 37.9 tp60 -63.88 -31.46 72.65 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 119.752 1.16 . . . . 0.0 111.294 -173.012 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.67 -36.39 62.8 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 121.56 -0.712 . . . . 0.0 110.186 177.848 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -56.86 -49.59 75.04 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 168.363 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 74' ' ' ILE . . . . . 0.403 ' CG2' ' CG2' ' A' ' 74' ' ' ILE . 24.2 mm -57.38 -39.1 66.24 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 O-C-N 121.963 -0.461 . . . . 0.0 110.012 175.821 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 55.3 m -62.45 -40.82 97.85 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 118.946 0.793 . . . . 0.0 110.608 175.769 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -53.37 -55.98 20.53 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 173.492 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 51.0 mt -61.16 -40.86 95.45 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 179.865 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -70.26 -43.87 61.7 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 110.788 -0.925 . . . . 0.0 110.788 -174.931 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.5 -46.89 81.01 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 117.705 0.752 . . . . 0.0 109.894 174.466 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 12.2 tp -49.7 -56.05 11.58 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.419 0.628 . . . . 0.0 109.559 174.274 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.08 -53.63 40.01 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.882 1.273 . . . . 0.0 110.802 177.481 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 52.9 ttm -54.11 -49.58 68.8 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 124.31 1.044 . . . . 0.0 110.552 -179.65 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 76.4 mt -62.54 -59.19 4.75 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.33 0 CA-C-O 118.701 -0.666 . . . . 0.0 109.586 -176.475 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.388 0.1 OUTLIER -71.25 -35.11 71.3 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 118.467 -1.293 . . . . 0.0 112.938 -174.365 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 37.3 m-80 -81.07 72.08 8.08 Favored 'General case' 0 N--CA 1.462 0.16 0 O-C-N 120.793 -1.192 . . . . 0.0 108.157 170.507 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -43.81 -34.45 1.58 Allowed 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 124.918 1.287 . . . . 0.0 112.725 -179.062 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -41.1 -42.82 2.08 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.876 1.27 . . . . 0.0 113.189 173.795 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 96.1 mt . . . . . 0 CA--C 1.532 0.286 0 C-N-CA 123.409 0.684 . . . . 0.0 112.718 -177.432 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.246 0 CA-C-O 121.192 0.52 . . . . 0.0 111.085 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.34 167.79 3.7 Favored Pre-proline 0 CA--C 1.534 0.347 0 C-N-CA 124.795 1.238 . . . . 0.0 111.339 172.878 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_endo -49.63 -45.05 33.08 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 122.926 2.417 . . . . 0.0 111.428 171.28 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.415 HD23 ' HA ' ' A' ' 5' ' ' LEU . 4.1 mt -53.74 -57.35 11.15 Favored 'General case' 0 C--O 1.224 -0.283 0 CA-C-N 118.02 0.373 . . . . 0.0 111.317 171.606 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -56.84 -42.23 79.29 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.176 0.444 . . . . 0.0 110.831 -174.999 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 -59.74 -50.71 72.76 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.54 0.736 . . . . 0.0 110.842 175.509 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.01 -45.96 83.37 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.577 0.751 . . . . 0.0 111.632 -176.462 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 87.1 mt -53.48 -51.02 45.67 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 169.887 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.04 -49.03 18.91 Favored Glycine 0 CA--C 1.528 0.88 0 C-N-CA 124.923 1.249 . . . . 0.0 112.005 173.55 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 mt -56.82 -55.16 37.89 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 117.947 0.873 . . . . 0.0 110.864 174.893 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.0 mp -57.49 -43.6 84.27 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 119.136 0.88 . . . . 0.0 111.38 -179.024 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 95.4 mt -58.32 -53.11 50.65 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.193 0 C-N-CA 123.497 0.719 . . . . 0.0 110.362 174.207 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.42 -49.66 67.53 Favored Glycine 0 CA--C 1.524 0.596 0 N-CA-C 110.322 -1.111 . . . . 0.0 110.322 -177.953 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 9.6 mm -53.32 -48.52 55.91 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 C-N-CA 123.572 0.749 . . . . 0.0 109.885 174.91 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 53.1 t80 -56.09 -61.13 2.59 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.258 0.481 . . . . 0.0 110.056 176.921 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -51.06 -39.69 56.56 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 125.74 1.616 . . . . 0.0 111.503 -176.27 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -50.93 -36.17 37.18 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.715 0.806 . . . . 0.0 111.506 178.913 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -107.05 -38.21 6.09 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.078 0.551 . . . . 0.0 111.654 -177.929 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 59.6 p . . . . . 0 C--O 1.232 0.134 0 CA-C-N 118.801 0.728 . . . . 0.0 111.772 -178.749 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.3 p . . . . . 0 CA--C 1.529 0.167 0 N-CA-C 111.841 0.311 . . . . 0.0 111.841 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -150.21 161.58 42.14 Favored 'General case' 0 CA--C 1.528 0.109 0 C-N-CA 123.034 0.534 . . . . 0.0 111.177 168.649 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 83.7 p -87.07 164.74 16.27 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 115.638 1.718 . . . . 0.0 115.638 -168.063 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 20.7 ttmm -42.6 -54.17 4.09 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 126.878 2.071 . . . . 0.0 109.442 166.685 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -58.01 -54.27 48.79 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.075 0.95 . . . . 0.0 109.782 179.247 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.12 -34.19 73.17 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 118.91 -0.567 . . . . 0.0 111.746 -177.49 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 44.0 mt -65.61 -52.71 49.95 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 119.276 0.943 . . . . 0.0 111.345 173.999 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -60.45 -35.96 77.08 Favored 'General case' 0 CA--C 1.532 0.261 0 O-C-N 122.3 -0.25 . . . . 0.0 110.439 -179.43 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 88.4 mt-10 -60.13 -68.71 0.27 Allowed 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 168.383 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.5 mt -32.57 -61.65 0.26 Allowed 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 125.94 1.696 . . . . 0.0 112.388 -177.965 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.3 tt -57.14 -52.19 59.41 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 110.337 -0.246 . . . . 0.0 110.337 -174.844 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.0 tt0 -64.33 -44.99 89.81 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 121.905 -0.497 . . . . 0.0 111.643 -177.874 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.0 mmpt? -64.6 -51.35 63.16 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 124.894 1.278 . . . . 0.0 110.219 -175.619 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 65.1 mm-40 -90.24 -47.52 7.73 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 123.483 0.713 . . . . 0.0 111.582 -168.911 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 18.1 mt . . . . . 0 C--N 1.339 0.122 0 CA-C-N 118.976 0.807 . . . . 0.0 110.386 -177.828 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 28.0 t70 . . . . . 0 N--CA 1.463 0.208 0 N-CA-C 116.066 1.876 . . . . 0.0 116.066 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -33.03 -59.06 0.36 Allowed 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.591 1.556 . . . . 0.0 113.396 -179.454 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -64.94 -36.88 85.8 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 121.255 0.55 . . . . 0.0 110.775 -173.815 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.499 ' H ' ' CD1' ' A' ' 53' ' ' ILE . 0.8 OUTLIER -65.56 -53.94 33.67 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.572 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 -178.068 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 75.4 t -57.91 -43.82 85.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 CA-C-O 118.633 -0.698 . . . . 0.0 110.451 178.86 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.72 -53.7 51.54 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 119.385 0.993 . . . . 0.0 110.459 174.301 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.6 mt -52.83 -44.26 66.58 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 119.104 -0.474 . . . . 0.0 111.404 178.651 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 25.9 mmt -66.84 -66.15 0.59 Allowed 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.529 0.604 . . . . 0.0 109.456 177.632 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -40.46 -42.68 1.67 Allowed 'General case' 0 CA--C 1.519 -0.243 0 C-N-CA 127.803 2.441 . . . . 0.0 111.648 -176.738 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -39.22 -47.7 1.68 Allowed 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 123.862 0.865 . . . . 0.0 112.72 178.042 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -64.35 -37.22 86.75 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.044 0.384 . . . . 0.0 111.385 -176.162 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -78.87 -36.88 41.52 Favored 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 123.841 0.856 . . . . 0.0 110.104 -178.284 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.2 ttm180 . . . . . 0 N--CA 1.449 -0.494 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 174.448 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 . . . . . 0 N--CA 1.456 -0.15 0 N-CA-C 111.803 0.297 . . . . 0.0 111.803 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 16.3 m -128.04 157.17 40.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.279 0 C-N-CA 125.325 1.45 . . . . 0.0 107.787 168.62 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -87.18 171.28 10.79 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.048 0.939 . . . . 0.0 111.495 173.522 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 68.8 t80 -44.45 -62.43 1.18 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.945 0.898 . . . . 0.0 113.141 176.172 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 37.0 tp60 -61.61 -34.48 75.73 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 119.722 1.146 . . . . 0.0 110.89 -174.795 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 83.5 mt-10 -64.45 -41.06 96.76 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.445 -0.784 . . . . 0.0 110.925 175.029 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -57.47 -47.97 80.44 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 121.606 -0.684 . . . . 0.0 109.899 169.824 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 31.0 mm -60.35 -29.56 44.48 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 O-C-N 121.503 -0.748 . . . . 0.0 110.767 175.281 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 29.2 m -69.93 -40.74 75.34 Favored 'General case' 0 C--O 1.225 -0.196 0 O-C-N 121.215 -0.928 . . . . 0.0 110.197 173.413 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -56.67 -53.67 54.95 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.571 -0.706 . . . . 0.0 109.576 173.413 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 61.2 mt -63.24 -41.12 99.04 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 121.947 -0.471 . . . . 0.0 111.988 178.437 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.79 -41.26 95.77 Favored Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.737 -0.945 . . . . 0.0 110.737 -179.076 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.34 -46.99 87.93 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.269 0.627 . . . . 0.0 110.127 173.453 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 9.8 tp -51.96 -58.3 6.92 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.714 0.768 . . . . 0.0 109.774 175.402 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -47.83 -53.39 15.72 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 114.486 -1.234 . . . . 0.0 110.089 178.077 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 46.0 ttm -57.59 -51.92 67.51 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 123.684 0.794 . . . . 0.0 111.343 -179.437 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 85.6 mt -61.7 -45.13 99.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.613 -173.712 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.457 0.1 OUTLIER -83.08 -33.99 26.27 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 179.982 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 -84.66 85.57 7.42 Favored 'General case' 0 N--CA 1.463 0.222 0 O-C-N 120.845 -1.159 . . . . 0.0 108.93 173.958 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -36.89 -42.06 0.37 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.654 1.181 . . . . 0.0 113.356 171.741 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -55.33 -17.07 4.12 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 125.298 1.439 . . . . 0.0 114.304 -179.516 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 69.8 mt . . . . . 0 CA--C 1.532 0.263 0 C-N-CA 124.608 1.163 . . . . 0.0 112.616 -179.114 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.299 0 N-CA-C 110.135 -0.32 . . . . 0.0 110.135 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -49.54 155.32 1.38 Allowed Pre-proline 0 CA--C 1.535 0.386 0 C-N-CA 125.354 1.462 . . . . 0.0 109.959 172.189 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_exo -43.76 -52.72 5.09 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 123.38 2.72 . . . . 0.0 113.165 -177.141 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.2 mt -55.44 -55.62 29.57 Favored 'General case' 0 C--O 1.226 -0.153 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 173.514 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -58.18 -38.17 76.15 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-N 118.301 0.5 . . . . 0.0 110.332 -175.048 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -68.55 -49.19 61.39 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 125.088 1.355 . . . . 0.0 110.155 -179.313 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.35 -47.39 86.25 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.553 0.741 . . . . 0.0 110.648 177.991 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 70.0 mt -52.48 -53.86 17.9 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 169.956 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.84 -44.24 17.63 Favored Glycine 0 CA--C 1.526 0.736 0 C-N-CA 125.752 1.644 . . . . 0.0 112.322 175.977 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.68 -53.01 62.96 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.809 0.844 . . . . 0.0 110.686 174.683 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 11.0 mp -58.25 -41.43 84.2 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 119.01 0.823 . . . . 0.0 111.395 178.008 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 84.6 mt -60.29 -51.7 69.91 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 123.651 0.78 . . . . 0.0 110.735 174.563 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.48 -49.21 70.74 Favored Glycine 0 CA--C 1.521 0.445 0 N-CA-C 109.685 -1.366 . . . . 0.0 109.685 -179.083 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.2 mm -54.42 -46.41 70.36 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 C-N-CA 123.139 0.576 . . . . 0.0 110.409 174.594 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 58.5 t80 -55.27 -62.65 1.53 Allowed 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 118.974 0.806 . . . . 0.0 109.949 175.205 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -53.15 -38.42 62.72 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.329 1.052 . . . . 0.0 111.66 -175.092 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -47.86 -38.39 16.06 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.059 0.944 . . . . 0.0 111.391 176.986 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -99.35 -59.09 1.79 Allowed 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 177.343 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 4.7 m . . . . . 0 C--O 1.227 -0.1 0 C-N-CA 124.215 1.006 . . . . 0.0 112.507 -175.019 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 3.8 m80 . . . . . 0 CA--C 1.535 0.396 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 2.4 p -122.56 167.32 13.52 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 127.232 2.213 . . . . 0.0 110.381 -179.888 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -152.53 163.52 39.42 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.771 0.829 . . . . 0.0 109.523 167.568 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 14.5 m -84.98 147.17 26.84 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.265 1.026 . . . . 0.0 110.241 176.987 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -53.7 -31.43 47.97 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 -175.176 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.4 tmmt? -50.34 -43.52 54.1 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.884 -0.51 . . . . 0.0 110.184 172.024 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -65.89 -29.68 70.15 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-O 117.847 -1.073 . . . . 0.0 111.794 177.107 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 89.5 mt -65.5 -48.88 71.05 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 120.522 1.51 . . . . 0.0 109.299 174.409 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 59.4 mtmt -60.5 -44.78 95.62 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.228 179.789 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 72.7 mt-10 -55.07 -66.52 0.39 Allowed 'General case' 0 C--O 1.219 -0.536 0 CA-C-O 118.552 -0.737 . . . . 0.0 109.585 170.252 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 9.4 mt -35.93 -60.56 0.53 Allowed 'General case' 0 C--O 1.23 0.065 0 C-N-CA 125.294 1.437 . . . . 0.0 111.475 -179.82 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 1.5 tp -60.36 -51.68 70.16 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.103 -174.605 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -66.07 -44.75 83.6 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.728 0.694 . . . . 0.0 111.986 -175.463 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 6.9 mmpt? -61.87 -58.89 6.21 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 125.4 1.48 . . . . 0.0 109.26 -179.138 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -79.46 -54.76 5.6 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.782 -0.644 . . . . 0.0 109.3 -170.069 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 42.1 mt . . . . . 0 C--N 1.334 -0.084 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 172.291 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 1.5 p30 . . . . . 0 N--CA 1.466 0.354 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.25 -66.65 0.09 Allowed 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 126.983 2.113 . . . . 0.0 114.221 -174.732 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -65.34 -39.16 92.03 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-O 121.051 0.453 . . . . 0.0 110.222 -171.024 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 53' ' ' ILE . . . . . 0.647 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.6 mp -64.35 -54.23 33.42 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 -176.946 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 75.6 t -58.09 -44.05 86.55 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.459 0 CA-C-O 118.406 -0.807 . . . . 0.0 110.196 178.794 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -54.92 -52.87 61.6 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 119.528 1.058 . . . . 0.0 110.509 174.396 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 37.0 mt -54.21 -46.18 72.39 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 119.17 -0.443 . . . . 0.0 111.243 179.496 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 26.5 mmt -66.9 -59.24 3.68 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.534 0.683 . . . . 0.0 109.868 179.309 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -48.71 -39.73 25.77 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 126.58 1.952 . . . . 0.0 111.337 -177.079 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -37.6 -50.22 1.14 Allowed 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 126.024 1.73 . . . . 0.0 112.507 -174.195 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 3.1 pp -62.97 -35.57 80.61 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 -175.366 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -85.99 -33.2 21.15 Favored 'General case' 0 C--O 1.224 -0.286 0 C-N-CA 123.184 0.593 . . . . 0.0 110.457 178.512 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 6.6 ttp180 -58.86 -56.62 19.84 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 122.111 0.957 . . . . 0.0 108.603 175.186 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 . . . . . 0 N--CA 1.45 -0.452 0 C-N-CA 124.238 1.015 . . . . 0.0 109.74 -172.73 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 . . . . . 0 N--CA 1.453 -0.302 0 CA-C-O 120.358 0.123 . . . . 0.0 110.923 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 6.0 m -136.88 160.0 36.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 C-N-CA 124.122 0.969 . . . . 0.0 109.471 169.236 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 17.4 p30 -85.94 169.2 13.48 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 125.759 1.623 . . . . 0.0 110.886 174.327 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -39.92 -58.75 1.33 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.982 1.313 . . . . 0.0 113.664 173.932 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 38.4 tp60 -61.76 -40.97 97.0 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 120.786 -1.196 . . . . 0.0 110.981 -174.239 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -68.02 -33.82 75.32 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.78 -0.575 . . . . 0.0 110.862 177.94 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -57.72 -55.09 39.33 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 168.669 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 22.1 mm -52.79 -42.62 42.89 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.212 0 C-N-CA 122.821 0.448 . . . . 0.0 109.95 179.7 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 49.5 m -55.4 -36.29 66.28 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 122.779 0.432 . . . . 0.0 111.376 178.425 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 18.3 t80 -58.46 -53.1 62.09 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 174.969 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 41.8 mt -60.51 -43.07 97.45 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.056 0.542 . . . . 0.0 111.17 178.715 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.23 -46.77 86.05 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 -176.654 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.39 -46.92 88.15 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 117.696 0.748 . . . . 0.0 110.543 175.84 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -51.83 -56.15 15.72 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.766 0.793 . . . . 0.0 109.983 174.426 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.43 -48.98 65.44 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 124.113 0.965 . . . . 0.0 110.474 178.457 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 50.3 ttm -58.3 -49.5 76.93 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.912 0.885 . . . . 0.0 110.971 179.855 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 84.1 mt -64.6 -43.39 96.72 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 CA-C-O 118.186 -0.912 . . . . 0.0 111.233 -175.596 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.445 1.3 p90 -79.43 -40.34 30.18 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.784 1.174 . . . . 0.0 113.607 178.694 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 37.4 m-80 -79.14 70.73 5.56 Favored 'General case' 0 N--CA 1.462 0.136 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 170.567 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -40.89 -41.98 1.73 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.521 1.528 . . . . 0.0 112.6 -174.841 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.29 -54.33 0.4 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.766 1.626 . . . . 0.0 113.044 169.954 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 85.4 mt . . . . . 0 C--O 1.225 -0.235 0 C-N-CA 124.146 0.978 . . . . 0.0 113.146 -173.555 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.225 0 CA-C-O 120.862 0.363 . . . . 0.0 110.238 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 4.2 m -53.35 160.54 1.74 Allowed Pre-proline 0 CA--C 1.536 0.442 0 C-N-CA 124.278 1.031 . . . . 0.0 111.113 175.09 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_exo -43.15 -49.5 7.13 Favored 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 123.528 2.819 . . . . 0.0 113.172 176.28 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.431 HD23 ' HA ' ' A' ' 5' ' ' LEU . 7.3 mt -57.25 -48.5 78.68 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 119.305 -0.379 . . . . 0.0 111.719 174.577 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -59.41 -47.18 86.46 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 118.548 0.613 . . . . 0.0 109.666 -177.081 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 16.0 tt0 -56.08 -52.69 63.38 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.355 0.662 . . . . 0.0 110.375 176.209 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.52 -45.11 84.75 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.383 0.673 . . . . 0.0 112.023 -174.606 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 76.0 mt -55.69 -50.18 69.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 171.534 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.21 -50.03 17.68 Favored Glycine 0 CA--C 1.528 0.863 0 C-N-CA 124.422 1.011 . . . . 0.0 111.488 173.609 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.1 mt -55.83 -56.76 16.77 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 117.586 0.693 . . . . 0.0 111.282 174.848 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -58.32 -44.14 88.51 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 119.257 0.935 . . . . 0.0 111.639 -177.659 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 96.3 mt -56.49 -54.91 22.77 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.2 0 C-N-CA 123.413 0.685 . . . . 0.0 110.198 173.181 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.64 -50.15 58.62 Favored Glycine 0 CA--C 1.523 0.567 0 N-CA-C 110.364 -1.094 . . . . 0.0 110.364 -177.351 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 9.5 mm -54.27 -47.62 68.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 C-N-CA 123.229 0.611 . . . . 0.0 110.107 175.915 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 50.6 t80 -56.1 -59.35 5.05 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.401 0.546 . . . . 0.0 109.998 176.506 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -56.62 -35.47 68.34 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.734 1.214 . . . . 0.0 111.514 -173.732 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -48.88 -36.33 16.81 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.943 0.897 . . . . 0.0 111.779 177.143 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 54.6 m-85 -106.81 -55.73 2.29 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.34 0.656 . . . . 0.0 109.393 178.461 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.531 0.217 0 C-N-CA 124.103 0.961 . . . . 0.0 111.645 -176.38 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.3 p . . . . . 0 N--CA 1.454 -0.242 0 N-CA-C 111.27 0.1 . . . . 0.0 111.27 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -144.46 163.56 33.45 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.573 0.349 . . . . 0.0 111.526 169.709 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 9.7 m -89.36 159.89 17.12 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.095 0.958 . . . . 0.0 113.438 -170.667 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 51.6 pttt -45.99 -42.84 13.64 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 125.272 1.429 . . . . 0.0 112.184 171.793 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 23.2 ttmm -51.97 -50.47 61.2 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 123.483 0.713 . . . . 0.0 110.302 172.815 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 -65.83 -39.99 91.35 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 118.776 -0.631 . . . . 0.0 110.324 -176.897 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 76.0 mt -58.82 -54.97 41.13 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.77 0.713 . . . . 0.0 111.161 173.462 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 61.8 mttm -56.56 -44.27 80.8 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.236 0.614 . . . . 0.0 110.187 -178.422 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -56.81 -67.93 0.27 Allowed 'General case' 0 C--O 1.219 -0.507 0 CA-C-O 118.423 -0.799 . . . . 0.0 109.473 170.555 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.7 mt -34.07 -62.98 0.3 Allowed 'General case' 0 N--CA 1.463 0.209 0 C-N-CA 125.594 1.558 . . . . 0.0 112.132 -178.542 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 18.1 tt -61.26 -48.0 90.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 C-N-CA 120.899 -0.321 . . . . 0.0 110.265 -174.356 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 65.7 tt0 -62.91 -45.55 91.98 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.783 -0.573 . . . . 0.0 111.712 -178.065 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.2 mmpt? -65.07 -58.68 5.44 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 125.397 1.479 . . . . 0.0 109.059 -176.727 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -77.78 -62.36 1.69 Allowed 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.311 -173.226 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 32.8 mt . . . . . 0 N--CA 1.45 -0.427 0 CA-C-O 121.394 0.616 . . . . 0.0 109.557 -174.956 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 38.2 t70 . . . . . 0 N--CA 1.463 0.197 0 N-CA-C 115.207 1.558 . . . . 0.0 115.207 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -31.99 -58.15 0.3 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 125.49 1.516 . . . . 0.0 113.35 176.866 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -65.92 -38.42 88.64 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 121.268 0.556 . . . . 0.0 111.197 -175.289 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.503 ' H ' ' CD1' ' A' ' 53' ' ' ILE . 1.0 OUTLIER -66.06 -50.13 71.55 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 N-CA-C 106.864 -1.532 . . . . 0.0 106.864 -176.157 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 71.6 t -55.49 -54.31 26.87 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 CA-C-O 118.475 -0.774 . . . . 0.0 109.364 174.682 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -47.98 -54.45 12.82 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.629 0.65 . . . . 0.0 110.847 179.332 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 12.8 mt -51.94 -43.35 63.42 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 122.879 0.472 . . . . 0.0 112.197 -177.249 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -78.69 -59.38 2.8 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 122.926 0.49 . . . . 0.0 110.335 -179.661 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -39.71 -37.2 0.49 Allowed 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 126.785 2.034 . . . . 0.0 111.872 176.575 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -36.75 -57.3 0.8 Allowed 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 125.239 1.416 . . . . 0.0 111.408 172.871 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -65.42 -30.75 71.59 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 121.856 -0.527 . . . . 0.0 111.658 -174.346 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -82.1 -36.67 27.33 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.43 0.692 . . . . 0.0 110.523 -175.036 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 13.1 ptt180 . . . . . 0 CA--C 1.532 0.269 0 CA-C-N 118.813 0.733 . . . . 0.0 109.422 173.714 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 . . . . . 0 CA--C 1.528 0.13 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.7 m -134.37 159.43 42.01 Favored 'Isoleucine or valine' 0 C--O 1.232 0.159 0 C-N-CA 126.224 1.81 . . . . 0.0 107.805 169.406 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -91.44 174.26 7.47 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 123.612 0.765 . . . . 0.0 111.59 175.798 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 49.3 t80 -42.31 -63.46 0.75 Allowed 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.376 1.07 . . . . 0.0 112.84 173.839 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -61.64 -35.25 77.38 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 120.329 1.422 . . . . 0.0 111.694 -176.179 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -63.6 -41.4 98.32 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 119.836 1.198 . . . . 0.0 111.315 174.33 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -55.04 -51.63 65.69 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 121.01 -1.056 . . . . 0.0 109.608 169.853 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 23.8 mm -55.97 -36.13 43.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 C-N-CA 122.804 0.442 . . . . 0.0 110.245 176.395 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 56.8 m -67.2 -34.48 77.6 Favored 'General case' 0 C--O 1.225 -0.223 0 O-C-N 121.302 -0.874 . . . . 0.0 110.635 177.06 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -53.91 -54.48 38.2 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 169.813 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 59.6 mt -64.2 -41.36 97.11 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.306 0.642 . . . . 0.0 112.034 -178.254 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -70.16 -44.46 60.27 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.416 -1.073 . . . . 0.0 110.416 -176.689 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.08 -49.58 76.74 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 122.171 -0.605 . . . . 0.0 109.754 174.393 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 11.1 tp -48.45 -59.27 3.61 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.464 0.65 . . . . 0.0 109.988 173.922 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -49.64 -53.02 26.59 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.804 1.242 . . . . 0.0 110.581 179.773 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 14.2 ttp -67.1 -36.61 82.31 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 123.357 0.663 . . . . 0.0 111.92 -175.166 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.93 -59.39 4.35 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 CA-C-N 118.791 0.723 . . . . 0.0 109.52 175.679 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.417 0.3 OUTLIER -70.91 -38.33 72.95 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 118.512 -1.275 . . . . 0.0 112.424 -174.21 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -81.78 67.68 7.85 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 120.545 -1.347 . . . . 0.0 107.639 168.994 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -41.24 -40.13 1.53 Allowed 'General case' 0 N--CA 1.462 0.155 0 C-N-CA 125.767 1.627 . . . . 0.0 112.293 -175.242 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -34.55 -53.28 0.52 Allowed 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 125.352 1.461 . . . . 0.0 113.037 172.401 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 90.9 mt . . . . . 0 C--O 1.225 -0.23 0 N-CA-C 113.156 0.798 . . . . 0.0 113.156 -174.226 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.227 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 11.9 m -53.8 159.7 2.51 Favored Pre-proline 0 CA--C 1.537 0.479 0 C-N-CA 123.741 0.816 . . . . 0.0 111.147 176.512 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_exo -42.11 -48.83 6.19 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 123.868 3.045 . . . . 0.0 113.507 177.645 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 6.3 mt -54.25 -51.11 65.55 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 119.564 -0.255 . . . . 0.0 111.521 174.051 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -62.99 -40.46 97.8 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 118.254 0.479 . . . . 0.0 110.144 -175.674 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.7 tp60 -63.9 -46.35 85.24 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 122.512 -0.118 . . . . 0.0 110.96 176.391 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.31 -46.01 88.71 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.593 0.757 . . . . 0.0 110.819 -179.313 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 63.0 mt -52.84 -53.23 22.27 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.254 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 169.678 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.77 -46.66 18.86 Favored Glycine 0 CA--C 1.528 0.854 0 C-N-CA 125.164 1.364 . . . . 0.0 112.05 175.422 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 mt -58.09 -54.19 49.81 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 117.71 0.755 . . . . 0.0 111.166 174.534 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 9.9 mp -57.91 -42.78 85.49 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 118.791 0.723 . . . . 0.0 111.407 179.323 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 85.9 mt -56.4 -56.13 15.27 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.401 0 C-N-CA 123.629 0.772 . . . . 0.0 109.669 173.316 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.2 -48.8 62.23 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.749 -0.94 . . . . 0.0 110.749 -177.754 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 9.1 mm -56.44 -47.23 81.93 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 175.978 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -55.99 -60.81 2.94 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 118.626 0.648 . . . . 0.0 109.923 176.484 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -43.32 -50.1 6.73 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 128.168 2.587 . . . . 0.0 110.467 -177.992 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -48.38 -36.84 15.41 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.583 1.153 . . . . 0.0 112.355 178.266 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 -119.48 36.12 4.6 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.124 0.97 . . . . 0.0 111.236 179.875 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 19.9 p . . . . . 0 N--CA 1.466 0.372 0 O-C-N 121.309 -0.869 . . . . 0.0 109.793 172.505 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 20.1 t-160 . . . . . 0 CA--C 1.54 0.595 0 N-CA-C 111.358 0.132 . . . . 0.0 111.358 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 73.4 p -128.33 164.81 21.83 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 124.819 1.248 . . . . 0.0 112.393 -173.136 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 3.4 pp -156.49 178.18 10.61 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.88 1.672 . . . . 0.0 107.225 169.78 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 61.8 p -123.46 177.03 5.82 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 119.326 0.966 . . . . 0.0 112.43 -177.369 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 7.0 ptpp? -40.3 -46.88 2.4 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 125.475 1.51 . . . . 0.0 112.945 175.659 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -62.59 -42.64 99.68 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -176.3 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -67.58 -41.44 84.12 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.301 178.182 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 34' ' ' LEU . . . . . 0.499 HD12 HD21 ' B' ' 63' ' ' ASN . 13.7 mt -58.98 -48.89 79.95 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 119.424 1.011 . . . . 0.0 111.107 175.23 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -57.22 -50.52 72.62 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 178.341 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 64.2 mt-10 -50.8 -62.25 1.72 Allowed 'General case' 0 C--O 1.223 -0.334 0 CA-C-O 119.432 -0.318 . . . . 0.0 110.359 173.619 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 12.3 mt -43.1 -64.86 0.56 Allowed 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.86 1.264 . . . . 0.0 110.841 179.573 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 13.8 tt -61.66 -47.73 91.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 C-N-CA 120.452 -0.499 . . . . 0.0 110.382 -171.456 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -67.37 -49.38 64.19 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 118.271 0.487 . . . . 0.0 111.819 -176.009 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.15 -55.38 16.65 Favored 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 -178.054 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -73.03 -51.21 19.05 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 122.354 -0.216 . . . . 0.0 110.43 -172.211 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 96.0 mt . . . . . 0 C--O 1.226 -0.139 0 CA-C-O 121.205 0.526 . . . . 0.0 111.099 -174.043 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 . . . . . 0 N--CA 1.463 0.214 0 N-CA-C 114.66 1.356 . . . . 0.0 114.66 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.68 -60.63 0.15 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.999 1.72 . . . . 0.0 114.264 -179.198 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -65.59 -38.69 90.23 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 121.306 0.574 . . . . 0.0 111.307 -174.058 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 53' ' ' ILE . . . . . 0.624 HD12 ' H ' ' B' ' 53' ' ' ILE . 2.4 mp -67.69 -52.97 34.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.548 0 N-CA-C 106.597 -1.631 . . . . 0.0 106.597 -176.443 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 55.4 t -49.18 -48.92 17.41 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 C-N-CA 125.003 1.321 . . . . 0.0 109.645 173.467 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -57.67 -50.02 74.56 Favored 'General case' 0 N--CA 1.457 -0.111 0 CA-C-N 118.577 0.626 . . . . 0.0 111.119 177.708 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 23.9 mt -54.74 -36.6 64.96 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 119.111 -0.471 . . . . 0.0 111.487 177.381 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 28.1 mmt -70.1 -59.52 2.85 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 118.963 0.801 . . . . 0.0 109.838 174.676 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 81.0 m-20 -45.55 -37.39 5.4 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 126.549 1.94 . . . . 0.0 111.27 -178.483 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -38.08 -51.9 1.41 Allowed 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 126.039 1.736 . . . . 0.0 111.029 176.398 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -59.77 -47.42 85.74 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 122.702 0.401 . . . . 0.0 110.35 -177.864 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -63.1 -53.96 45.41 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 122.703 0.401 . . . . 0.0 110.072 -179.418 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 61.4 mtp180 -54.98 -41.86 71.73 Favored 'General case' 0 N--CA 1.456 -0.157 0 O-C-N 121.955 -0.466 . . . . 0.0 110.301 179.897 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 63' ' ' ASN . . . . . 0.499 HD21 HD12 ' B' ' 34' ' ' LEU . 15.4 m-80 . . . . . 0 N--CA 1.455 -0.195 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 179.098 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 . . . . . 0 N--CA 1.453 -0.277 0 CA-C-O 120.94 0.4 . . . . 0.0 110.74 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 10.1 m -130.92 158.63 43.26 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 C-N-CA 126.686 1.995 . . . . 0.0 106.666 168.849 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -99.81 175.2 5.87 Favored 'General case' 0 N--CA 1.462 0.13 0 C-N-CA 124.053 0.941 . . . . 0.0 111.13 177.688 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -40.96 -63.83 0.62 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.239 1.015 . . . . 0.0 112.61 172.38 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 50.9 tp60 -61.52 -36.34 80.28 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 119.59 1.087 . . . . 0.0 111.711 -174.842 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -62.7 -43.01 99.9 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.374 -0.829 . . . . 0.0 110.775 175.62 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -56.29 -51.29 68.71 Favored 'General case' 0 CA--C 1.535 0.403 0 O-C-N 121.838 -0.539 . . . . 0.0 109.884 170.975 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 27.5 mm -55.58 -37.57 46.4 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 O-C-N 121.959 -0.463 . . . . 0.0 110.289 177.554 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 47.8 m -64.76 -37.11 86.51 Favored 'General case' 0 CA--C 1.529 0.139 0 O-C-N 121.682 -0.636 . . . . 0.0 110.603 175.95 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -55.82 -52.98 62.14 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 173.663 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 54.6 mt -62.29 -44.69 95.94 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.55 179.377 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -60.99 -47.91 88.9 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 110.681 -0.968 . . . . 0.0 110.681 -178.901 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.16 -41.22 94.9 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 122.147 -0.619 . . . . 0.0 110.407 177.433 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 23.0 tp -54.04 -56.82 14.36 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 118.636 0.653 . . . . 0.0 109.688 174.611 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -48.58 -50.92 30.36 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 124.524 1.129 . . . . 0.0 109.989 175.891 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 44.7 ttm -58.15 -49.11 78.12 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.209 0.604 . . . . 0.0 111.669 -179.078 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 81.1 mt -65.27 -51.12 68.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.67 -176.033 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.45 0.1 OUTLIER -76.34 -38.64 55.63 Favored 'General case' 0 C--N 1.345 0.392 0 CA-C-N 119.678 1.127 . . . . 0.0 112.958 -177.153 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 23.2 m-80 -82.93 68.57 9.47 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 169.33 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 87.8 mt-10 -41.56 -38.57 1.37 Allowed 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 125.749 1.619 . . . . 0.0 112.688 -173.309 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -35.44 -53.97 0.66 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.046 1.338 . . . . 0.0 112.768 171.583 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 92.3 mt . . . . . 0 CA--C 1.53 0.178 0 C-N-CA 124.037 0.935 . . . . 0.0 113.347 -174.46 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.1 mtm . . . . . 0 N--CA 1.475 0.787 0 CA-C-O 120.671 0.272 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.26 68.55 3.4 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 176.14 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -56.57 165.04 1.76 Allowed Pre-proline 0 CA--C 1.538 0.499 0 C-N-CA 124.651 1.18 . . . . 0.0 111.461 -179.556 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -44.03 -48.49 9.32 Favored 'Trans proline' 0 N--CA 1.458 -0.563 0 C-N-CA 123.805 3.004 . . . . 0.0 113.535 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.1 mt -53.39 -56.7 14.59 Favored 'General case' 0 C--O 1.226 -0.173 0 CA-C-N 117.66 0.209 . . . . 0.0 111.47 173.247 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -59.82 -41.78 92.05 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -174.488 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 tp-100 -60.47 -50.13 74.81 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.619 0.767 . . . . 0.0 110.437 176.8 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.31 -44.77 94.02 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.331 0.652 . . . . 0.0 111.213 -178.28 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 74.1 mt -52.41 -53.01 21.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 169.676 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.55 -47.97 17.24 Favored Glycine 0 CA--C 1.528 0.85 0 C-N-CA 125.254 1.406 . . . . 0.0 112.029 174.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 mt -56.77 -55.9 28.39 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 117.904 0.852 . . . . 0.0 111.051 174.502 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -56.92 -42.61 80.3 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 119.152 0.887 . . . . 0.0 111.318 -179.127 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 87.3 mt -57.11 -54.42 30.46 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 C-N-CA 123.305 0.642 . . . . 0.0 110.843 172.774 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.91 -49.87 64.32 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.211 -1.155 . . . . 0.0 110.211 -177.387 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 12.5 mm -52.48 -50.14 40.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 C-N-CA 124.027 0.931 . . . . 0.0 110.067 175.339 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -53.79 -62.29 1.75 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 121.346 0.593 . . . . 0.0 109.822 176.088 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -55.39 -35.12 64.98 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.001 0.92 . . . . 0.0 111.873 -173.67 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -48.7 -36.3 15.87 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.886 0.874 . . . . 0.0 111.659 176.416 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 56.3 m-85 -103.61 -56.43 2.21 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 123.125 0.57 . . . . 0.0 109.756 176.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.0 m -50.54 -37.24 38.25 Favored 'General case' 0 C--O 1.227 -0.08 0 C-N-CA 123.533 0.733 . . . . 0.0 111.93 -176.792 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -40.48 -43.28 2.84 Favored Glycine 0 CA--C 1.526 0.73 0 C-N-CA 124.64 1.114 . . . . 0.0 112.933 174.391 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp -72.78 -21.81 60.93 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 122.687 0.395 . . . . 0.0 111.989 -174.108 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -80.58 2.06 27.15 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.67 0.788 . . . . 0.0 112.685 -170.708 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 75.78 -67.68 2.29 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.26 -1.136 . . . . 0.0 110.26 179.101 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -78.6 65.11 3.79 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 170.34 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 8.9 ptpt -66.31 5.02 0.61 Allowed 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 115.146 1.536 . . . . 0.0 115.146 -169.479 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 6.3 m80 -79.26 -14.99 58.68 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.68 1.592 . . . . 0.0 109.668 169.006 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 69.5 p -128.17 169.4 14.17 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 126.299 1.839 . . . . 0.0 110.815 179.441 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.83 -171.73 3.21 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 125.952 1.701 . . . . 0.0 107.556 168.26 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 92.2 p -145.49 177.0 9.17 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 119.589 1.086 . . . . 0.0 112.672 -176.156 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -18.61 -64.64 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 130.919 3.687 . . . . 0.0 113.257 172.402 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.09 -53.23 59.57 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 123.918 0.887 . . . . 0.0 111.201 -178.016 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -61.87 -38.08 86.95 Favored 'General case' 0 C--O 1.222 -0.357 0 C-N-CA 123.077 0.551 . . . . 0.0 110.424 179.481 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 43.7 mt -64.81 -48.78 73.17 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 118.676 0.671 . . . . 0.0 110.979 178.658 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -57.69 -47.9 81.04 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 110.218 -0.29 . . . . 0.0 110.218 175.768 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -52.14 -59.14 4.72 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-O 119.396 -0.335 . . . . 0.0 110.695 172.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.3 mt -45.01 -61.53 1.59 Allowed 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 124.771 1.228 . . . . 0.0 110.551 -178.164 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 12.5 tt -62.08 -51.55 71.07 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 119.983 -0.687 . . . . 0.0 109.717 -174.406 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -61.88 -44.8 96.07 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.8 -0.562 . . . . 0.0 112.263 -174.493 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -75.12 -58.28 3.38 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 -177.545 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 18.0 mp0 -77.66 -18.82 56.32 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 117.634 -1.174 . . . . 0.0 113.305 -168.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 67.0 mt -102.76 92.44 4.61 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-N 120.133 1.333 . . . . 0.0 107.639 167.259 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 68.6 p -77.38 60.24 1.99 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.358 1.063 . . . . 0.0 109.184 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 33.5 mt -86.58 -55.05 7.06 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 C-N-CA 124.751 1.221 . . . . 0.0 109.207 -173.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.8 -67.47 1.34 Allowed Glycine 0 CA--C 1.531 1.037 0 N-CA-C 110.707 -0.957 . . . . 0.0 110.707 -174.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 60.5 p -72.01 78.82 0.92 Allowed 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.739 0.816 . . . . 0.0 109.454 175.129 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -33.15 92.69 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 127.615 2.366 . . . . 0.0 112.105 175.888 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 95.2 mt -61.79 117.98 6.57 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.814 0.845 . . . . 0.0 113.032 -169.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 61.94 -78.0 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 126.102 1.761 . . . . 0.0 113.607 167.09 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -168.11 -47.3 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 124.226 1.011 . . . . 0.0 109.826 -169.448 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -34.89 -63.21 0.33 Allowed 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 125.144 1.378 . . . . 0.0 112.796 -178.074 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 67.4 tt0 -62.9 -37.01 85.22 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.327 0.651 . . . . 0.0 111.456 -174.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.495 ' H ' ' CD1' ' A' ' 53' ' ' ILE . 0.9 OUTLIER -62.37 -53.99 40.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 N-CA-C 105.868 -1.901 . . . . 0.0 105.868 -179.193 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 75.1 t -57.15 -41.19 77.36 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.606 0 CA-C-O 118.035 -0.983 . . . . 0.0 110.498 177.494 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.6 mmmt -58.18 -51.7 68.66 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 120.167 1.349 . . . . 0.0 110.192 176.523 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 49.5 mt -55.73 -43.77 76.9 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 119.162 -0.447 . . . . 0.0 110.925 179.474 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 22.1 mmt -67.15 -60.75 2.35 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 118.807 0.73 . . . . 0.0 109.624 178.466 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -42.73 -45.56 4.8 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 126.746 2.018 . . . . 0.0 111.213 -178.691 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -39.41 -47.79 1.84 Allowed 'General case' 0 C--O 1.234 0.252 0 C-N-CA 124.578 1.151 . . . . 0.0 112.36 178.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -57.99 -48.22 80.64 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-O 119.456 -0.307 . . . . 0.0 110.345 -178.356 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -71.02 -49.05 49.26 Favored 'General case' 0 C--O 1.227 -0.126 0 CA-C-N 118.14 0.427 . . . . 0.0 110.335 -178.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 54.5 ttt85 -49.95 -43.54 50.04 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 124.788 1.235 . . . . 0.0 110.613 -178.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 12.9 m-80 -86.63 -58.87 2.45 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 122.434 0.294 . . . . 0.0 111.054 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . 0.366 17.3 ptpt 48.19 -72.98 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 127.74 2.416 . . . . 0.0 113.295 -168.083 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -143.37 26.9 1.59 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.109 0.964 . . . . 0.0 111.131 176.254 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -128.75 142.21 51.07 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.796 0.838 . . . . 0.0 110.366 179.306 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 22.2 mp0 -69.89 151.8 45.25 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.314 1.046 . . . . 0.0 108.286 168.5 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.2 m -108.39 149.44 11.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 169.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 17.9 p30 -88.69 170.66 10.61 Favored 'General case' 0 C--O 1.23 0.077 0 C-N-CA 124.325 1.05 . . . . 0.0 110.832 175.43 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -38.58 -61.42 0.71 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.83 1.252 . . . . 0.0 113.74 174.346 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 40.8 tp60 -62.66 -38.75 91.54 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 120.025 1.284 . . . . 0.0 110.669 -174.433 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.85 -33.5 75.98 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.888 -0.507 . . . . 0.0 110.947 176.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -61.18 -53.27 59.11 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 118.841 0.746 . . . . 0.0 109.182 168.679 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 24.2 mm -52.24 -42.54 37.0 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 C-N-CA 122.844 0.458 . . . . 0.0 110.097 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 34.0 m -54.17 -37.76 64.81 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.049 0.54 . . . . 0.0 111.378 177.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -57.34 -50.18 73.78 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 176.026 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 51.5 mt -65.63 -43.65 88.86 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.186 0.595 . . . . 0.0 111.329 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.63 -43.41 97.97 Favored Glycine 0 CA--C 1.529 0.919 0 N-CA-C 110.945 -0.862 . . . . 0.0 110.945 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.81 -49.84 73.35 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 123.095 0.558 . . . . 0.0 110.383 175.622 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 16.4 tp -47.37 -56.48 6.81 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.401 0.619 . . . . 0.0 109.948 173.436 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.96 -53.57 39.77 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.555 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 9.2 mtm -57.46 -50.45 72.99 Favored 'General case' 0 N--CA 1.455 -0.203 0 O-C-N 123.327 0.392 . . . . 0.0 111.861 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 84.0 mt -63.41 -49.96 80.61 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-O 117.79 -1.1 . . . . 0.0 110.34 -174.139 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.467 0.4 OUTLIER -78.18 -40.36 37.97 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-N 120.256 1.389 . . . . 0.0 113.504 -178.508 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.0 m-80 -82.53 67.22 8.49 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 169.514 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 90.2 mt-10 -41.37 -42.64 2.29 Favored 'General case' 0 N--CA 1.461 0.099 0 C-N-CA 125.281 1.432 . . . . 0.0 112.12 -172.181 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -31.42 -52.75 0.22 Allowed 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 126.561 1.944 . . . . 0.0 113.372 171.644 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 63.8 mt -59.24 -24.08 62.89 Favored 'General case' 0 C--O 1.224 -0.256 0 C-N-CA 123.717 0.807 . . . . 0.0 113.103 -175.157 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -77.76 -15.07 59.37 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 119.522 1.055 . . . . 0.0 111.59 177.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.161 0 CA-C-O 117.205 -1.886 . . . . 0.0 111.185 -178.158 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 91.6 mmm . . . . . 0 N--CA 1.475 0.788 0 CA-C-O 120.404 0.145 . . . . 0.0 110.636 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -78.41 64.48 3.5 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 176.03 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.3 m -57.54 165.91 1.99 Allowed Pre-proline 0 CA--C 1.537 0.477 0 C-N-CA 125.082 1.353 . . . . 0.0 111.109 179.232 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 99.1 Cg_exo -45.45 -47.53 12.96 Favored 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 123.524 2.816 . . . . 0.0 113.477 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.9 mt -54.39 -55.53 27.7 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-N 117.817 0.28 . . . . 0.0 111.435 173.422 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -59.43 -39.67 84.27 Favored 'General case' 0 C--O 1.225 -0.22 0 N-CA-C 110.385 -0.228 . . . . 0.0 110.385 -176.021 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 12.4 tp-100 -63.37 -50.41 70.04 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.507 0.723 . . . . 0.0 110.501 177.648 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.28 -45.03 93.34 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.313 0.645 . . . . 0.0 111.095 -178.726 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 72.7 mt -53.14 -53.23 23.79 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 N-CA-C 108.107 -1.071 . . . . 0.0 108.107 169.647 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.43 -45.86 16.82 Favored Glycine 0 CA--C 1.526 0.751 0 C-N-CA 125.69 1.614 . . . . 0.0 112.176 175.328 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.7 mt -57.87 -55.99 27.8 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 117.751 0.776 . . . . 0.0 110.97 173.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.6 mp -58.69 -43.02 89.85 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.18 0.9 . . . . 0.0 111.608 -179.045 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 75.0 mt -54.12 -57.23 6.34 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 C-N-CA 124.09 0.956 . . . . 0.0 109.981 171.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.02 -50.44 58.91 Favored Glycine 0 CA--C 1.522 0.497 0 N-CA-C 110.249 -1.14 . . . . 0.0 110.249 -176.019 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 13.9 mm -51.56 -50.28 30.55 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 C-N-CA 123.523 0.729 . . . . 0.0 110.04 175.075 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -56.9 -57.72 11.26 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.252 178.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -56.72 -38.44 72.35 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.843 0.857 . . . . 0.0 111.139 -174.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -46.09 -39.14 8.93 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.601 1.161 . . . . 0.0 111.571 -179.342 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -107.2 -52.01 2.83 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 122.542 0.337 . . . . 0.0 110.11 178.341 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 5.6 m -52.72 -36.17 57.05 Favored 'General case' 0 CA--C 1.527 0.081 0 C-N-CA 123.573 0.749 . . . . 0.0 111.981 -177.01 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -41.15 -47.5 4.35 Favored Glycine 0 CA--C 1.527 0.832 0 C-N-CA 124.192 0.901 . . . . 0.0 111.834 172.58 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -65.87 -22.08 66.5 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 122.736 0.415 . . . . 0.0 111.847 -173.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 44.7 mm-40 -75.68 -7.52 54.53 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.692 0.397 . . . . 0.0 111.819 178.379 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 77.21 -63.74 3.23 Favored Glycine 0 CA--C 1.527 0.791 0 N-CA-C 110.302 -1.119 . . . . 0.0 110.302 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 60.4 t0 -78.08 65.32 3.45 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 170.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 60.8 pttt -69.34 12.18 0.19 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 125.474 1.51 . . . . 0.0 114.809 -169.125 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 19.9 t-160 -78.98 -23.87 44.2 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 124.691 1.196 . . . . 0.0 108.064 166.399 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 56.9 p -125.58 157.94 35.88 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 125.162 1.385 . . . . 0.0 111.968 -172.423 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.88 178.44 9.4 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 125.372 1.469 . . . . 0.0 107.703 168.109 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 4.3 m -135.5 173.31 11.86 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.412 0.685 . . . . 0.0 112.793 -170.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 37.2 ttmt -19.52 -68.86 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 130.44 3.496 . . . . 0.0 113.824 175.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 3.0 tppp? -56.08 -53.55 55.67 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.586 0.755 . . . . 0.0 109.959 -175.304 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -57.04 -41.71 79.15 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 123.516 0.726 . . . . 0.0 110.989 178.524 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 39.4 mt -61.47 -50.05 74.33 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 118.478 0.581 . . . . 0.0 111.212 178.507 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -59.55 -47.7 84.51 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 179.227 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -50.71 -55.91 14.42 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.314 0.646 . . . . 0.0 111.403 171.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 3.1 mt -45.43 -65.25 0.56 Allowed 'General case' 0 CA--C 1.521 -0.151 0 C-N-CA 124.514 1.126 . . . . 0.0 110.994 176.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 14.8 tt -61.19 -47.61 92.75 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 C-N-CA 120.056 -0.658 . . . . 0.0 109.827 -173.124 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -53.94 -50.12 67.16 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.016 0.926 . . . . 0.0 111.866 -178.948 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 50.9 mtmt -76.21 -49.48 17.04 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 122.359 0.264 . . . . 0.0 111.076 -176.082 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -78.02 -32.44 51.04 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 118.533 -0.746 . . . . 0.0 112.795 -169.215 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 48.7 mt -91.54 91.61 8.13 Favored 'General case' 0 C--N 1.338 0.089 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 169.013 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 62.2 p -75.83 62.76 1.59 Allowed 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 124.49 1.116 . . . . 0.0 108.867 178.46 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 64.7 mt -92.68 -65.08 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 C-N-CA 124.703 1.201 . . . . 0.0 108.284 -176.395 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.68 -67.53 0.78 Allowed Glycine 0 CA--C 1.53 1.004 0 N-CA-C 110.305 -1.118 . . . . 0.0 110.305 -174.551 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 19.8 m -67.3 75.74 0.15 Allowed 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 125.139 1.375 . . . . 0.0 109.707 170.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 47' ' ' LYS . . . . . 0.485 ' HB3' HD11 ' B' ' 53' ' ' ILE . 35.2 mmtp -39.62 93.28 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 127.012 2.125 . . . . 0.0 112.377 -177.777 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 90.5 mt -42.57 -54.99 3.7 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 125.62 1.568 . . . . 0.0 113.019 -173.293 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -162.34 157.76 23.15 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 -174.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -32.62 -45.5 0.12 Allowed 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 128.511 2.724 . . . . 0.0 113.886 -173.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -30.3 -55.7 0.19 Allowed 'General case' 0 C--O 1.227 -0.102 0 C-N-CA 125.907 1.683 . . . . 0.0 113.695 178.038 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -66.1 -42.17 89.63 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 121.069 0.461 . . . . 0.0 110.701 -174.16 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 53' ' ' ILE . . . . . 0.558 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.1 mp -61.26 -52.97 55.22 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 N-CA-C 106.636 -1.616 . . . . 0.0 106.636 179.292 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 69.9 t -57.08 -43.72 81.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 C-N-CA 124.362 1.065 . . . . 0.0 110.233 -178.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -55.92 -54.78 40.56 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 119.418 1.008 . . . . 0.0 110.497 172.807 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 43.5 mt -53.36 -42.09 66.49 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 119.04 -0.505 . . . . 0.0 111.359 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 22.9 mmt -68.76 -61.86 1.63 Allowed 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 118.741 0.701 . . . . 0.0 109.613 177.038 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -40.94 -46.98 2.92 Favored 'General case' 0 CA--C 1.516 -0.333 0 C-N-CA 127.626 2.37 . . . . 0.0 111.113 -177.455 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -39.71 -49.22 2.26 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.071 0.949 . . . . 0.0 112.513 177.377 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 10.0 mp -59.74 -56.02 27.05 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -177.268 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -61.27 -40.87 95.7 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 123.444 0.698 . . . . 0.0 111.245 -178.271 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 52.5 ttt180 -62.94 -50.54 70.4 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 124.035 0.934 . . . . 0.0 109.798 -178.559 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 -73.71 -50.33 21.36 Favored 'General case' 0 C--O 1.227 -0.082 0 N-CA-C 110.586 -0.153 . . . . 0.0 110.586 -176.2 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 50.9 mttp 62.69 -80.98 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.498 1.119 . . . . 0.0 108.938 -168.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -153.49 36.8 0.46 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 126.301 1.84 . . . . 0.0 108.866 170.232 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -124.26 139.01 54.32 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 125.588 1.555 . . . . 0.0 108.031 -175.592 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -68.54 159.0 32.7 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.852 0.861 . . . . 0.0 110.378 174.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 12.0 m -115.67 148.03 18.67 Favored 'Isoleucine or valine' 0 C--O 1.235 0.303 0 N-CA-C 107.062 -1.459 . . . . 0.0 107.062 168.712 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -89.39 177.6 6.54 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.542 0.737 . . . . 0.0 111.287 175.251 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -47.35 -60.02 2.8 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.623 0.769 . . . . 0.0 111.94 175.398 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 40.3 tp60 -58.9 -37.93 77.75 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 119.218 0.917 . . . . 0.0 111.264 -176.029 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -63.26 -42.79 99.18 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.502 -0.749 . . . . 0.0 111.032 176.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -55.67 -48.59 74.79 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.64 -0.663 . . . . 0.0 109.915 170.54 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 28.0 mm -59.05 -32.47 47.89 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 O-C-N 121.601 -0.687 . . . . 0.0 110.76 175.589 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 23.4 m -66.37 -41.75 88.99 Favored 'General case' 0 C--O 1.225 -0.189 0 O-C-N 121.265 -0.897 . . . . 0.0 109.822 174.237 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -56.3 -52.92 62.74 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 174.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 49.2 mt -60.07 -46.13 90.59 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 120.933 0.397 . . . . 0.0 111.664 177.35 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.28 -39.2 97.58 Favored Glycine 0 CA--C 1.525 0.662 0 N-CA-C 110.948 -0.861 . . . . 0.0 110.948 -176.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.33 -47.14 77.54 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.431 0.692 . . . . 0.0 110.175 174.132 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 14.5 tp -51.33 -54.36 27.03 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 175.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.83 -57.33 9.65 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 114.872 -1.058 . . . . 0.0 109.995 177.532 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 49.5 ttm -48.09 -51.14 25.74 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.785 0.834 . . . . 0.0 110.755 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 33.6 mt -69.91 -48.49 63.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-O 117.859 -1.067 . . . . 0.0 111.201 -172.318 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.426 0.0 OUTLIER -87.99 -34.74 17.94 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 115.157 1.54 . . . . 0.0 115.157 -176.593 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 33.4 m120 -80.0 68.6 6.16 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 172.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -33.55 -43.79 0.13 Allowed 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 127.725 2.41 . . . . 0.0 114.364 -174.136 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -40.5 -41.5 1.44 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.572 1.549 . . . . 0.0 113.038 176.266 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 96.0 mt -62.4 -28.32 69.7 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -179.085 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 57.7 mtmt -89.06 -47.2 8.28 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.559 0.743 . . . . 0.0 109.401 172.011 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.143 0 CA-C-O 117.489 -1.728 . . . . 0.0 110.035 179.395 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.2 ttt . . . . . 0 N--CA 1.474 0.731 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -71.62 80.05 0.82 Allowed 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 122.88 0.472 . . . . 0.0 110.892 -175.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -54.86 161.57 2.25 Favored Pre-proline 0 CA--C 1.542 0.636 0 C-N-CA 124.012 0.925 . . . . 0.0 111.093 173.192 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -48.94 -49.26 15.59 Favored 'Trans proline' 0 N--CA 1.458 -0.592 0 C-N-CA 123.009 2.472 . . . . 0.0 112.424 177.442 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 5' ' ' LEU . 6.6 mt -58.45 -45.54 88.35 Favored 'General case' 0 C--O 1.223 -0.309 0 CA-C-O 118.985 -0.531 . . . . 0.0 111.013 175.484 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -57.86 -46.09 85.33 Favored 'General case' 0 C--O 1.227 -0.111 0 CA-C-N 118.771 0.714 . . . . 0.0 109.758 -178.601 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 12.5 tp60 -61.17 -49.07 78.71 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 122.05 0.14 . . . . 0.0 111.052 177.142 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.12 -46.91 79.06 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 121.503 0.668 . . . . 0.0 111.474 -175.637 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 76.9 mt -53.74 -53.56 25.53 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.233 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 170.406 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -45.96 -47.41 14.53 Favored Glycine 0 CA--C 1.528 0.857 0 C-N-CA 124.78 1.181 . . . . 0.0 111.807 175.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.2 mt -55.94 -57.18 13.2 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.22 0.608 . . . . 0.0 110.963 173.34 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.5 mp -57.44 -43.78 84.17 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.26 0.937 . . . . 0.0 111.899 -178.786 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 63.6 mt -55.01 -57.93 5.61 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 C-N-CA 123.627 0.771 . . . . 0.0 109.814 172.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -53.72 -49.95 55.93 Favored Glycine 0 CA--C 1.522 0.518 0 N-CA-C 110.411 -1.076 . . . . 0.0 110.411 -176.254 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 11.7 mm -52.62 -49.59 44.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 C-N-CA 123.581 0.752 . . . . 0.0 110.318 175.247 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -56.72 -57.42 12.5 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 118.307 0.503 . . . . 0.0 110.147 177.752 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -59.18 -37.09 76.54 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 123.549 0.74 . . . . 0.0 111.388 -172.763 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -46.64 -40.84 13.76 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 124.738 1.215 . . . . 0.0 111.41 178.22 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -96.55 -59.44 1.82 Allowed 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 176.686 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.4 m -47.87 -42.25 26.28 Favored 'General case' 0 CA--C 1.527 0.082 0 C-N-CA 123.984 0.914 . . . . 0.0 112.273 -171.752 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -38.77 -48.48 2.45 Favored Glycine 0 C--N 1.341 0.828 0 C-N-CA 124.606 1.098 . . . . 0.0 112.207 176.213 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.27 -30.98 71.51 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 122.821 0.449 . . . . 0.0 111.486 -172.319 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.2 mp0 -80.15 0.17 33.41 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 119.115 -0.469 . . . . 0.0 111.986 -176.484 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 78.06 -61.92 3.72 Favored Glycine 0 CA--C 1.527 0.827 0 CA-C-N 119.383 0.992 . . . . 0.0 110.825 174.091 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 55.8 t0 -78.38 60.49 2.59 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 170.222 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 23.5 pttm -69.62 8.62 0.62 Allowed 'General case' 0 N--CA 1.457 -0.104 0 C-N-CA 126.846 2.058 . . . . 0.0 114.333 -169.194 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 4.7 m80 -80.03 -19.43 47.69 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 126.172 1.789 . . . . 0.0 108.871 170.007 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.2 p -132.65 158.67 41.69 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 127.722 2.409 . . . . 0.0 110.374 -177.202 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.34 178.61 9.42 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 125.471 1.509 . . . . 0.0 107.38 168.532 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 7.3 t -134.39 -168.5 2.15 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.462 1.028 . . . . 0.0 113.675 -174.284 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 21.2 pttt -48.81 -53.3 19.77 Favored 'General case' 0 C--O 1.228 -0.06 0 C-N-CA 126.146 1.778 . . . . 0.0 115.001 -168.702 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -54.05 -47.69 71.36 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 118.795 0.725 . . . . 0.0 109.961 179.512 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -63.03 -39.93 96.21 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 123.281 0.632 . . . . 0.0 110.79 178.718 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.1 mp -61.6 -49.08 78.03 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.901 0.773 . . . . 0.0 112.192 174.128 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -56.02 -47.79 77.16 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 176.62 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -54.78 -57.04 13.13 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-O 119.148 -0.453 . . . . 0.0 111.168 173.232 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.6 mt -46.42 -60.49 2.31 Favored 'General case' 0 C--N 1.333 -0.136 0 C-N-CA 123.836 0.854 . . . . 0.0 110.333 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 13.5 tt -62.72 -50.86 78.03 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 C-N-CA 120.44 -0.504 . . . . 0.0 109.879 -176.034 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -59.94 -47.42 85.85 Favored 'General case' 0 CA--C 1.537 0.471 0 O-C-N 121.152 -0.967 . . . . 0.0 112.235 -175.537 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -76.13 -55.93 5.13 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.819 -0.551 . . . . 0.0 109.707 -177.356 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -84.77 -19.38 32.68 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 -168.194 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 30.3 mt -117.02 61.93 0.73 Allowed 'General case' 0 N--CA 1.461 0.096 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 169.328 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 64.5 p -34.89 -72.73 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 126.691 1.997 . . . . 0.0 112.169 -176.034 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 87.3 mt 64.44 -67.22 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 C-N-CA 127.002 2.121 . . . . 0.0 113.186 170.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.34 -65.47 1.31 Allowed Glycine 0 CA--C 1.529 0.919 0 N-CA-C 110.125 -1.19 . . . . 0.0 110.125 -171.079 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 17.5 m -68.14 74.81 0.22 Allowed 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 125.594 1.558 . . . . 0.0 111.019 175.283 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 41.5 mmtm -34.69 92.67 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 127.696 2.398 . . . . 0.0 112.331 -179.304 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 80.9 mt -59.78 109.77 1.0 Allowed 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.79 0.836 . . . . 0.0 113.114 -169.827 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 63.12 -77.36 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 126.163 1.785 . . . . 0.0 113.471 167.053 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -167.93 -47.43 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 124.156 0.982 . . . . 0.0 109.59 -169.371 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -36.13 -58.99 0.64 Allowed 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 125.078 1.351 . . . . 0.0 112.581 -179.504 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 87.7 tt0 -61.4 -39.76 91.89 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.942 0.897 . . . . 0.0 111.388 -176.42 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.467 ' H ' ' CD1' ' A' ' 53' ' ' ILE . 0.9 OUTLIER -65.2 -54.58 27.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 106.45 -1.685 . . . . 0.0 106.45 -176.552 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 78.5 t -56.76 -42.18 76.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.046 177.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.8 mptp? -55.89 -54.31 46.24 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 119.091 0.86 . . . . 0.0 110.607 175.519 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 27.5 mt -53.26 -39.3 63.78 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 119.369 -0.348 . . . . 0.0 111.503 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.89 -62.66 1.42 Allowed 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 118.537 0.608 . . . . 0.0 110.078 177.208 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -43.33 -40.14 3.45 Favored 'General case' 0 CA--C 1.523 -0.074 0 C-N-CA 127.062 2.145 . . . . 0.0 111.987 -178.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -39.81 -47.82 2.17 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.303 1.041 . . . . 0.0 112.736 173.307 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.8 mp -66.49 -34.15 77.28 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 122.898 0.479 . . . . 0.0 110.901 -179.011 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -74.41 -51.93 13.56 Favored 'General case' 0 N--CA 1.456 -0.128 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 -179.188 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 17.4 mtp85 -44.39 -56.29 4.34 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.624 0.77 . . . . 0.0 109.231 170.101 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -93.05 37.33 1.03 Allowed 'General case' 0 C--O 1.234 0.25 0 C-N-CA 122.964 0.506 . . . . 0.0 111.502 -178.274 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 20.0 ttmm -74.42 72.8 1.87 Allowed 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 172.28 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 69.92 42.2 1.06 Allowed 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 126.801 2.04 . . . . 0.0 111.648 -171.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -134.28 161.48 34.83 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 108.477 -0.935 . . . . 0.0 108.477 168.661 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -113.5 131.76 55.94 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 105.11 -2.182 . . . . 0.0 105.11 166.327 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 11.6 m -86.34 135.59 24.73 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 -178.693 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -79.8 171.03 15.67 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 123.731 0.812 . . . . 0.0 111.027 176.523 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -42.51 -59.52 1.85 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.502 0.721 . . . . 0.0 112.831 176.065 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.2 tp60 -63.85 -33.52 75.87 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 120.9 -1.125 . . . . 0.0 111.113 -175.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -64.81 -41.84 95.47 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 121.385 -0.822 . . . . 0.0 110.779 174.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -55.94 -50.59 70.35 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.414 -0.804 . . . . 0.0 109.38 170.242 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.1 mm -56.66 -37.94 55.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 O-C-N 121.922 -0.486 . . . . 0.0 110.451 176.143 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 33.2 m -62.63 -39.44 93.85 Favored 'General case' 0 C--O 1.226 -0.137 0 CA-C-N 118.95 0.796 . . . . 0.0 110.013 176.88 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -55.19 -53.97 49.22 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 173.004 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 53.5 mt -60.91 -45.16 95.74 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 122.04 -0.413 . . . . 0.0 112.017 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.35 -45.34 91.08 Favored Glycine 0 CA--C 1.524 0.616 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 -176.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.51 -45.51 92.66 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 117.691 0.745 . . . . 0.0 110.187 175.397 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 12.7 tp -51.87 -56.02 16.55 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 118.488 0.585 . . . . 0.0 109.786 174.743 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.06 -53.32 34.86 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.332 1.053 . . . . 0.0 110.669 178.381 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 44.6 ttm -55.55 -50.76 69.18 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 125.082 1.353 . . . . 0.0 110.757 -179.05 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 62.8 mt -65.92 -53.34 39.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-O 118.454 -0.784 . . . . 0.0 110.265 -175.736 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.473 0.1 OUTLIER -74.54 -37.55 63.01 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-N 119.739 1.154 . . . . 0.0 113.126 -176.057 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 25.0 m-80 -82.66 61.55 5.82 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 168.653 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.71 -37.06 3.46 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.88 1.272 . . . . 0.0 112.332 -174.518 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -31.96 -48.36 0.16 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 127.699 2.4 . . . . 0.0 113.306 169.421 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 46.2 mt -54.66 -33.25 60.45 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 -177.193 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 9.0 mtmp? -77.01 63.06 2.25 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.868 0.758 . . . . 0.0 111.72 -172.217 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.162 0 CA-C-O 117.3 -1.834 . . . . 0.0 111.025 172.929 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 26.9 ptm . . . . . 0 N--CA 1.471 0.607 0 N-CA-C 110.761 -0.088 . . . . 0.0 110.761 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.6 72.02 0.5 Allowed 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.895 0.878 . . . . 0.0 110.746 -178.008 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 10.5 m -62.76 163.5 15.62 Favored Pre-proline 0 CA--C 1.538 0.484 0 C-N-CA 125.871 1.668 . . . . 0.0 109.206 178.661 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -48.14 -48.33 16.92 Favored 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 122.921 2.414 . . . . 0.0 113.006 -176.521 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.8 mt -53.73 -52.54 59.81 Favored 'General case' 0 C--O 1.225 -0.192 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 172.363 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -61.57 -38.74 88.62 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-N 118.063 0.392 . . . . 0.0 110.565 -176.147 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.2 tp-100 -62.82 -50.9 69.16 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.291 0.636 . . . . 0.0 110.213 176.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.67 -45.93 91.89 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.44 0.638 . . . . 0.0 111.193 -179.339 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 67.4 mt -53.44 -51.24 43.33 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 170.359 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -48.59 -47.73 29.38 Favored Glycine 0 CA--C 1.525 0.713 0 C-N-CA 125.359 1.456 . . . . 0.0 111.619 175.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 mt -54.88 -55.21 32.95 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 117.525 0.662 . . . . 0.0 110.651 173.137 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -57.07 -43.6 82.26 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.007 0.822 . . . . 0.0 111.616 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 94.6 mt -56.07 -55.55 17.76 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 C-N-CA 123.487 0.715 . . . . 0.0 110.091 173.765 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.09 -48.49 73.52 Favored Glycine 0 CA--C 1.523 0.588 0 N-CA-C 110.802 -0.919 . . . . 0.0 110.802 -178.027 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.5 mm -53.58 -47.53 60.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 C-N-CA 123.183 0.593 . . . . 0.0 110.011 175.416 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -56.36 -57.37 12.55 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.476 0.58 . . . . 0.0 109.543 175.048 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -52.49 -40.17 62.06 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 125.491 1.516 . . . . 0.0 112.113 -173.276 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 65.0 tttp -50.96 -34.71 29.98 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.128 1.371 . . . . 0.0 111.467 176.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 71.5 m-85 -101.96 -60.89 1.46 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.615 0.766 . . . . 0.0 110.806 179.103 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 5.0 p -80.39 -61.85 1.85 Allowed 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 123.335 0.654 . . . . 0.0 110.743 -174.528 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -47.26 -37.12 10.98 Favored Glycine 0 CA--C 1.526 0.741 0 C-N-CA 125.425 1.488 . . . . 0.0 114.593 -169.074 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -65.13 -31.57 72.83 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 118.206 1.003 . . . . 0.0 112.609 177.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -75.03 161.26 29.6 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.538 1.135 . . . . 0.0 109.422 177.145 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -55.19 -47.2 75.64 Favored Glycine 0 CA--C 1.531 1.089 0 O-C-N 121.987 -0.446 . . . . 0.0 112.242 -178.326 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -79.79 60.81 3.54 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.84 0.856 . . . . 0.0 110.314 -177.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 24.5 mtmm -48.2 -33.59 8.76 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.379 1.072 . . . . 0.0 113.883 -169.539 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 9.5 t-80 -77.98 -10.83 59.78 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -172.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 4.8 p -136.58 162.46 33.06 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.898 0.879 . . . . 0.0 112.89 -168.195 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -161.34 174.24 13.81 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.695 1.198 . . . . 0.0 109.255 168.103 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -115.41 171.83 7.47 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.054 0.941 . . . . 0.0 112.832 -169.662 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 14.3 ptmt -35.93 -57.98 0.66 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 127.521 2.328 . . . . 0.0 114.414 179.295 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.17 -45.43 87.49 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 122.805 0.442 . . . . 0.0 110.118 -178.144 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -62.87 -39.42 94.39 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 123.299 0.64 . . . . 0.0 110.936 177.45 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 5.9 mt -61.41 -49.82 75.31 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 119.096 0.862 . . . . 0.0 111.849 173.118 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 89.3 mttt -55.52 -46.84 76.98 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 122.114 -0.366 . . . . 0.0 110.266 176.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -54.62 -55.06 33.4 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 118.856 -0.592 . . . . 0.0 110.915 173.325 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 8.3 mt -46.38 -61.38 1.82 Allowed 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.295 0.638 . . . . 0.0 110.43 179.133 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 18.4 tt -59.62 -54.5 33.71 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 119.916 -0.713 . . . . 0.0 110.156 -176.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -60.79 -46.11 91.79 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 118.606 0.639 . . . . 0.0 112.673 -173.404 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -74.8 -52.75 10.62 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.13 0.572 . . . . 0.0 109.626 -177.474 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 55.4 mm-40 -81.96 -27.52 33.21 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -167.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 41.0 mt -104.94 95.08 5.62 Favored 'General case' 0 CA--C 1.523 -0.083 0 N-CA-C 105.114 -2.18 . . . . 0.0 105.114 167.438 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 66.9 p -77.39 58.11 1.63 Allowed 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.366 1.066 . . . . 0.0 109.818 -172.212 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 65.6 mt -105.61 76.94 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.643 0 N-CA-C 106.544 -1.65 . . . . 0.0 106.544 -172.712 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.43 -53.12 46.71 Favored Glycine 0 CA--C 1.528 0.854 0 N-CA-C 108.632 -1.787 . . . . 0.0 108.632 169.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 6.7 m -66.96 80.4 0.12 Allowed 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.54 1.136 . . . . 0.0 109.97 171.207 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 43.8 mmtm -46.95 92.94 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.99 1.716 . . . . 0.0 111.359 177.623 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 95.0 mt -50.88 -53.99 27.75 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 124.419 1.088 . . . . 0.0 112.433 -170.155 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -162.72 155.51 19.36 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 -170.798 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -19.96 -51.16 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 129.798 3.239 . . . . 0.0 115.367 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.84 -60.97 0.16 Allowed 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 125.912 1.685 . . . . 0.0 113.35 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -66.15 -39.83 90.11 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 120.792 0.33 . . . . 0.0 110.954 -174.374 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 53' ' ' ILE . . . . . 0.478 ' H ' ' CD1' ' B' ' 53' ' ' ILE . 0.9 OUTLIER -61.06 -57.6 11.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 -177.937 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 52.5 t -57.77 -39.39 70.48 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 CA-C-N 115.01 -0.995 . . . . 0.0 110.187 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -56.17 -52.14 65.45 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 119.794 1.179 . . . . 0.0 111.229 174.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 68.1 mt -55.38 -40.54 71.48 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 119.345 -0.359 . . . . 0.0 111.205 -179.592 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.47 -60.69 2.1 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 118.839 0.745 . . . . 0.0 110.132 176.366 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -40.46 -46.13 2.37 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 127.369 2.268 . . . . 0.0 111.7 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -39.55 -48.23 2.02 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.449 1.1 . . . . 0.0 112.112 175.423 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 63.2 mt -57.9 -50.83 72.0 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.508 0.723 . . . . 0.0 110.017 -179.232 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -67.21 -41.16 86.23 Favored 'General case' 0 C--O 1.226 -0.15 0 C-N-CA 123.194 0.598 . . . . 0.0 111.067 -178.38 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 53.3 ttm-85 -60.01 -48.21 82.64 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.464 1.106 . . . . 0.0 109.977 -179.247 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -79.63 -48.32 13.95 Favored 'General case' 0 C--O 1.228 -0.051 0 CA-C-O 120.703 0.287 . . . . 0.0 111.316 -177.537 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 48.1 mttm 61.84 -87.56 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 124.788 1.235 . . . . 0.0 107.741 -167.043 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -150.82 41.07 0.75 Allowed 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 125.511 1.524 . . . . 0.0 108.577 169.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 19.5 mm-40 -131.43 151.26 51.7 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 125.589 1.555 . . . . 0.0 107.392 172.675 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 44.9 mp0 -77.49 143.89 38.14 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 124.408 1.083 . . . . 0.0 109.874 -178.135 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 35.6 m -86.27 154.94 3.38 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 168.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 16.3 p30 -97.93 171.13 8.48 Favored 'General case' 0 CA--C 1.528 0.111 0 C-N-CA 124.797 1.239 . . . . 0.0 111.425 176.518 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -41.59 -60.98 1.16 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.402 1.081 . . . . 0.0 113.16 175.083 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 41.1 tp60 -63.51 -34.0 76.82 Favored 'General case' 0 C--O 1.225 -0.211 0 O-C-N 121.036 -1.04 . . . . 0.0 110.879 -175.431 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 54.7 mm-40 -63.01 -45.43 92.4 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 118.932 0.787 . . . . 0.0 111.17 173.225 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -53.67 -50.03 66.7 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.697 -0.627 . . . . 0.0 109.846 171.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 27.1 mm -58.01 -38.42 66.92 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 O-C-N 121.855 -0.528 . . . . 0.0 110.652 176.064 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 70.7 m -63.11 -41.71 99.4 Favored 'General case' 0 C--O 1.226 -0.174 0 O-C-N 121.506 -0.746 . . . . 0.0 109.972 176.609 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -56.37 -54.28 47.48 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 174.705 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 42.2 mt -58.82 -47.65 84.04 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 121.975 -0.453 . . . . 0.0 112.032 178.639 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.75 -43.94 97.02 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 110.87 -0.892 . . . . 0.0 110.87 -176.687 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.07 -48.26 79.42 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 121.988 -0.713 . . . . 0.0 110.205 176.374 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -49.56 -56.83 8.53 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-O 121.864 0.84 . . . . 0.0 109.88 173.837 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.94 -54.54 23.37 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 114.612 -1.176 . . . . 0.0 110.376 179.163 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 19.7 ttp -62.4 -45.57 92.52 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 123.596 0.758 . . . . 0.0 111.648 -177.165 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 75.4 mt -60.66 -47.88 91.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.012 -177.258 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.484 0.0 OUTLIER -82.45 -34.16 28.25 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 114.476 1.287 . . . . 0.0 114.476 -179.926 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -80.6 75.05 7.5 Favored 'General case' 0 N--CA 1.462 0.159 0 O-C-N 120.779 -1.201 . . . . 0.0 108.505 171.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -40.41 -37.99 0.76 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.834 1.654 . . . . 0.0 112.977 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -39.93 -42.3 1.32 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.527 1.531 . . . . 0.0 113.46 173.33 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 93.9 mt -76.76 -12.34 59.97 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.763 0.825 . . . . 0.0 113.029 -176.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 9.9 mtmp? -100.41 -45.12 5.67 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 124.334 1.054 . . . . 0.0 110.263 174.607 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.124 0 CA-C-O 117.484 -1.731 . . . . 0.0 110.273 -178.518 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.8 mtm . . . . . 0 N--CA 1.474 0.762 0 N-CA-C 110.778 -0.082 . . . . 0.0 110.778 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 48.3 68.74 0.64 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 124.82 1.248 . . . . 0.0 111.972 179.075 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -50.32 158.33 1.03 Allowed Pre-proline 0 CA--C 1.54 0.586 0 C-N-CA 124.702 1.201 . . . . 0.0 111.541 177.314 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_exo -44.67 -49.89 8.89 Favored 'Trans proline' 0 N--CA 1.46 -0.491 0 C-N-CA 123.501 2.801 . . . . 0.0 113.404 -179.542 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.407 HD23 ' HA ' ' A' ' 5' ' ' LEU . 6.2 mt -55.9 -48.96 74.71 Favored 'General case' 0 C--O 1.226 -0.164 0 O-C-N 122.427 -0.17 . . . . 0.0 111.316 174.874 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -59.77 -46.9 87.75 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -177.376 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 12.2 tp60 -59.92 -47.27 86.47 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 122.505 0.322 . . . . 0.0 110.736 177.744 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.59 -46.04 77.25 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.091 0.472 . . . . 0.0 111.412 -176.201 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 77.9 mt -54.2 -50.66 54.06 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 170.391 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.46 -48.14 22.14 Favored Glycine 0 CA--C 1.528 0.89 0 C-N-CA 124.966 1.27 . . . . 0.0 111.893 174.545 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.9 mt -55.52 -56.8 16.02 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 117.71 0.755 . . . . 0.0 110.553 174.232 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.6 mp -57.98 -43.46 86.56 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 119.018 0.826 . . . . 0.0 111.752 -178.108 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 73.5 mt -55.48 -56.53 11.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 C-N-CA 124.03 0.932 . . . . 0.0 110.356 173.255 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.58 -49.33 65.74 Favored Glycine 0 CA--C 1.523 0.542 0 N-CA-C 110.544 -1.022 . . . . 0.0 110.544 -177.692 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 8.7 mm -54.03 -48.44 64.39 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 C-N-CA 123.674 0.79 . . . . 0.0 110.148 176.099 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -54.98 -61.4 2.33 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 118.45 0.568 . . . . 0.0 109.525 176.036 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -53.42 -39.32 64.27 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.583 0.753 . . . . 0.0 111.633 -174.169 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -50.64 -36.77 37.01 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.842 0.857 . . . . 0.0 111.734 178.161 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -101.12 -53.37 3.04 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.306 0.642 . . . . 0.0 110.028 -178.474 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m -54.82 -32.59 60.57 Favored 'General case' 0 CA--C 1.529 0.144 0 O-C-N 121.322 -0.861 . . . . 0.0 111.907 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -44.53 -34.14 3.49 Favored Glycine 0 CA--C 1.531 1.054 0 CA-C-O 118.74 -1.033 . . . . 0.0 113.528 173.113 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 5.7 ptmm? -104.54 29.54 6.06 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.581 1.19 . . . . 0.0 112.876 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -115.29 149.83 37.21 Favored 'General case' 0 C--O 1.225 -0.231 0 N-CA-C 107.442 -1.318 . . . . 0.0 107.442 169.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -53.9 -64.99 3.75 Favored Glycine 0 CA--C 1.529 0.964 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 -175.214 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -79.92 86.0 5.48 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 169.562 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -57.05 -11.43 1.54 Allowed 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 -174.384 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 24.1 m80 -78.94 -5.07 52.82 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.094 0.957 . . . . 0.0 111.568 174.711 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 48.0 p -133.92 168.22 19.17 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.073 1.349 . . . . 0.0 109.379 -178.826 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -154.79 159.04 40.35 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 122.631 0.372 . . . . 0.0 111.463 169.617 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 81.0 p -103.38 167.12 10.01 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.782 0.833 . . . . 0.0 112.936 -169.837 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.0 pttm -32.98 -48.69 0.21 Allowed 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 127.158 2.183 . . . . 0.0 113.987 170.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.5 tmmm? -60.1 -52.23 66.25 Favored 'General case' 0 N--CA 1.453 -0.311 0 O-C-N 121.969 -0.457 . . . . 0.0 109.9 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -61.08 -36.35 79.41 Favored 'General case' 0 C--O 1.223 -0.311 0 CA-C-O 119.346 -0.359 . . . . 0.0 110.776 178.092 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 48.6 mt -67.99 -49.9 58.86 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.575 0.625 . . . . 0.0 111.659 179.498 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp -60.46 -39.71 88.56 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 121.912 -0.493 . . . . 0.0 109.972 176.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -56.88 -63.96 1.03 Allowed 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 169.07 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.7 mt -39.49 -58.64 1.23 Allowed 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 125.212 1.405 . . . . 0.0 112.266 -178.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 16.0 tt -58.61 -51.37 72.63 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 -177.736 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -59.26 -42.01 90.15 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 120.995 -1.065 . . . . 0.0 112.718 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.1 mmpt? -77.7 -49.53 14.27 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 125.256 1.423 . . . . 0.0 110.694 -170.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -102.77 -24.05 13.75 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.914 1.286 . . . . 0.0 112.709 -168.803 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 69.5 mt -110.7 60.57 0.61 Allowed 'General case' 0 CA--C 1.527 0.064 0 N-CA-C 107.384 -1.339 . . . . 0.0 107.384 169.025 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 32.3 p -51.11 -54.33 26.09 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.529 0.731 . . . . 0.0 109.831 -178.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 80.9 mt 61.4 -64.13 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 C-N-CA 126.906 2.082 . . . . 0.0 113.242 174.83 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.25 -66.87 1.86 Allowed Glycine 0 CA--C 1.525 0.672 0 N-CA-C 109.861 -1.295 . . . . 0.0 109.861 -177.644 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 10.0 m -68.13 74.88 0.22 Allowed 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 124.523 1.129 . . . . 0.0 109.509 170.553 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 30.4 mmtp -44.21 93.75 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 126.16 1.784 . . . . 0.0 110.799 179.405 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 91.3 mt -49.4 -58.77 4.53 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 125.096 1.358 . . . . 0.0 112.609 -168.638 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -166.04 157.72 13.91 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 107.519 -1.289 . . . . 0.0 107.519 -175.304 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -30.25 -46.6 0.07 Allowed 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 128.901 2.881 . . . . 0.0 113.808 -174.51 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.27 -54.89 0.14 Allowed 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.948 1.699 . . . . 0.0 113.357 177.038 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 74.4 tt0 -67.29 -42.98 82.86 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.482 0.658 . . . . 0.0 111.031 -175.382 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.456 ' N ' HD12 ' A' ' 53' ' ' ILE . 1.1 mp -62.22 -50.6 79.33 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 N-CA-C 106.565 -1.643 . . . . 0.0 106.565 -178.242 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 77.1 t -54.09 -56.25 10.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 N-CA-C 109.09 -0.708 . . . . 0.0 109.09 176.422 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.9 mptt -45.23 -52.54 9.38 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 123.235 0.614 . . . . 0.0 112.317 -179.616 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 15.3 mt -50.07 -42.31 49.68 Favored 'General case' 0 CA--C 1.535 0.378 0 O-C-N 123.194 0.309 . . . . 0.0 111.815 -179.068 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 1.2 mpp? -81.39 -66.15 0.92 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.694 0.798 . . . . 0.0 109.642 179.149 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -40.29 -37.73 0.69 Allowed 'General case' 0 N--CA 1.461 0.093 0 C-N-CA 127.503 2.321 . . . . 0.0 112.789 -178.222 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -38.45 -53.37 1.55 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.939 0.896 . . . . 0.0 112.124 172.625 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -60.51 -37.1 80.04 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 110.564 -0.162 . . . . 0.0 110.564 -175.651 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -73.82 -51.53 16.03 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.624 0.77 . . . . 0.0 109.83 -177.139 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.7 -31.51 72.76 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 120.435 0.159 . . . . 0.0 111.001 -177.485 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -73.03 -68.03 0.52 Allowed 'General case' 0 C--O 1.231 0.1 0 O-C-N 121.686 -0.634 . . . . 0.0 109.786 171.295 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt 62.44 -72.82 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.062 1.745 . . . . 0.0 109.332 -168.006 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -131.88 -18.24 2.72 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.674 1.59 . . . . 0.0 111.869 172.925 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 19.0 tt0 -67.87 110.7 3.96 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.564 0.746 . . . . 0.0 110.823 -173.757 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 51.6 mp0 -68.23 114.86 7.07 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 105.429 -2.063 . . . . 0.0 105.429 167.102 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.0 m -79.05 138.03 20.78 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 -169.707 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -79.82 171.89 14.51 Favored 'General case' 0 C--O 1.231 0.113 0 C-N-CA 122.685 0.394 . . . . 0.0 110.577 176.465 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -43.95 -56.93 3.61 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.623 0.769 . . . . 0.0 112.673 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 34.8 tp60 -63.73 -33.71 76.25 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 120.968 -1.083 . . . . 0.0 110.789 -176.025 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -66.62 -42.01 87.48 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 118.761 0.709 . . . . 0.0 110.641 176.358 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -54.69 -48.59 72.25 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 121.653 -0.654 . . . . 0.0 109.813 169.78 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.449 ' CG2' ' CG2' ' B' ' 74' ' ' ILE . 24.4 mm -62.51 -29.75 47.56 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 O-C-N 121.828 -0.545 . . . . 0.0 111.275 175.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 39.1 m -68.23 -43.7 77.35 Favored 'General case' 0 C--O 1.225 -0.205 0 O-C-N 120.922 -1.112 . . . . 0.0 109.496 173.739 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 58.1 t80 -56.28 -58.06 9.6 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 175.774 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 71.1 mt -61.3 -44.48 97.15 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 122.101 -0.374 . . . . 0.0 111.79 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.78 -44.03 95.37 Favored Glycine 0 CA--C 1.527 0.811 0 N-CA-C 111.071 -0.812 . . . . 0.0 111.071 -176.704 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.12 -47.92 75.46 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 117.798 0.799 . . . . 0.0 109.938 176.835 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 37.6 tp -47.11 -57.31 5.23 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 121.786 0.803 . . . . 0.0 110.226 172.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -53.38 -49.51 67.06 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 114.633 -1.167 . . . . 0.0 110.904 177.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 44.9 ttm -57.68 -51.23 70.37 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.171 0.988 . . . . 0.0 110.689 -179.156 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 65.4 mt -61.32 -50.71 79.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-O 118.287 -0.863 . . . . 0.0 109.577 -176.725 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.431 1.7 p90 -72.89 -40.79 65.3 Favored 'General case' 0 C--N 1.347 0.469 0 C-N-CA 118.818 -1.153 . . . . 0.0 113.301 -177.464 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 43.7 m-80 -78.81 74.85 5.33 Favored 'General case' 0 N--CA 1.462 0.135 0 O-C-N 121.077 -1.015 . . . . 0.0 108.634 172.407 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -39.56 -41.55 1.03 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.525 1.53 . . . . 0.0 113.074 -179.187 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -38.37 -46.41 1.12 Allowed 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.349 1.46 . . . . 0.0 112.885 173.114 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.0 mt -72.16 6.11 2.39 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.315 1.046 . . . . 0.0 113.367 -175.715 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt -111.73 3.68 17.95 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.218 1.007 . . . . 0.0 110.63 169.088 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.201 0 CA-C-O 117.29 -1.839 . . . . 0.0 110.231 -179.217 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 76.0 mtp . . . . . 0 N--CA 1.474 0.742 0 CA-C-O 120.547 0.213 . . . . 0.0 110.476 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.14 73.53 3.72 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 122.164 -0.335 . . . . 0.0 110.633 -178.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 2.9 m -52.83 159.41 1.81 Allowed Pre-proline 0 CA--C 1.542 0.655 0 C-N-CA 123.56 0.744 . . . . 0.0 110.976 171.609 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -49.02 -50.08 13.66 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 123.067 2.512 . . . . 0.0 113.099 -177.255 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.3 mt -55.56 -45.07 77.33 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 173.117 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -64.21 -38.57 91.52 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 118.35 0.523 . . . . 0.0 109.868 -176.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 14.2 tp60 -64.43 -46.75 81.87 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.542 0.337 . . . . 0.0 110.838 174.345 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.39 -47.87 80.24 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.539 0.685 . . . . 0.0 110.989 -178.638 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 74.6 mt -53.35 -51.95 36.19 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 169.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.66 -43.48 21.99 Favored Glycine 0 CA--C 1.526 0.773 0 C-N-CA 125.717 1.627 . . . . 0.0 112.109 175.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 mt -59.38 -54.15 50.04 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 117.704 0.752 . . . . 0.0 110.598 173.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.7 mp -58.23 -43.66 87.85 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 118.814 0.734 . . . . 0.0 111.341 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 76.3 mt -56.03 -55.93 15.63 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.157 0 C-N-CA 123.825 0.85 . . . . 0.0 109.921 173.67 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -53.97 -50.61 54.22 Favored Glycine 0 CA--C 1.521 0.445 0 N-CA-C 110.023 -1.231 . . . . 0.0 110.023 -177.38 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 8.6 mm -53.0 -48.88 51.55 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 C-N-CA 123.508 0.723 . . . . 0.0 110.586 175.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -57.24 -60.99 2.79 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.949 0.404 . . . . 0.0 109.953 177.296 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -52.07 -40.63 61.48 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 125.418 1.487 . . . . 0.0 111.564 -174.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -46.36 -34.6 4.72 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.538 1.535 . . . . 0.0 111.623 179.314 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 85.4 m-85 -110.71 -50.15 2.98 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 122.817 0.447 . . . . 0.0 110.786 177.274 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 12.4 p -55.16 -38.05 67.78 Favored 'General case' 0 C--O 1.227 -0.104 0 C-N-CA 123.427 0.691 . . . . 0.0 111.126 -174.56 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -47.96 -30.5 7.24 Favored Glycine 0 CA--C 1.53 0.995 0 C-N-CA 124.431 1.015 . . . . 0.0 113.413 177.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 8.6 mtmp? -78.73 -27.76 44.9 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 118.045 0.923 . . . . 0.0 112.137 -178.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 49.9 mm-40 -73.58 146.65 44.56 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -176.471 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -48.55 -56.09 10.05 Favored Glycine 0 CA--C 1.529 0.936 0 C-N-CA 123.479 0.561 . . . . 0.0 112.057 -173.665 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 52.2 t0 -85.14 84.27 7.75 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 172.437 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 25.2 mmtm -40.0 -40.54 1.06 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.212 1.805 . . . . 0.0 114.295 -169.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 17.7 p-80 -80.98 12.13 3.54 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -176.765 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 32.6 p -132.49 164.41 26.64 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 123.947 0.899 . . . . 0.0 109.739 176.333 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -160.21 167.21 28.12 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.771 0.428 . . . . 0.0 110.936 169.736 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 46.7 m -113.71 170.09 8.5 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.923 1.289 . . . . 0.0 113.449 -169.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -32.2 -52.23 0.27 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 128.299 2.64 . . . . 0.0 115.265 178.375 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -59.03 -59.29 5.7 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -178.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -52.48 -39.88 61.69 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 123.521 0.728 . . . . 0.0 111.37 177.052 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 54.3 mt -65.05 -51.31 62.25 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 118.8 0.727 . . . . 0.0 112.079 179.5 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 8.2 mtmp? -61.77 -45.3 94.48 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 121.662 -0.649 . . . . 0.0 109.908 178.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -49.93 -56.91 8.74 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.45 0.7 . . . . 0.0 110.512 169.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 4.1 mt -45.5 -61.79 1.54 Allowed 'General case' 0 CA--C 1.521 -0.173 0 C-N-CA 124.351 1.06 . . . . 0.0 110.416 177.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 2.8 tp -60.55 -49.25 85.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 -173.376 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 -55.17 -48.55 73.62 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.302 1.041 . . . . 0.0 111.838 -178.463 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 8.5 mtmp? -76.66 -53.11 8.45 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 120.914 0.388 . . . . 0.0 111.264 -176.311 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -78.89 -26.47 43.86 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -167.835 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 49.9 mt -102.63 94.27 5.55 Favored 'General case' 0 N--CA 1.456 -0.132 0 N-CA-C 106.438 -1.69 . . . . 0.0 106.438 167.632 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 70.9 p -77.98 57.72 1.81 Allowed 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.62 0.768 . . . . 0.0 109.043 -177.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 45.6 mt -85.0 -60.2 2.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 C-N-CA 124.55 1.14 . . . . 0.0 107.925 -175.783 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 69.75 -70.38 0.56 Allowed Glycine 0 CA--C 1.529 0.906 0 N-CA-C 110.327 -1.109 . . . . 0.0 110.327 -176.081 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 20.1 m -66.05 79.32 0.09 Allowed 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 125.443 1.497 . . . . 0.0 109.59 171.345 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 47' ' ' LYS . . . . . 0.441 ' HB3' HD11 ' B' ' 53' ' ' ILE . 39.6 mmtm -42.4 93.15 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.709 2.004 . . . . 0.0 112.127 -178.613 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 89.5 mt -44.96 -53.89 7.16 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 125.655 1.582 . . . . 0.0 113.017 -171.77 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -161.91 158.49 25.4 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 107.215 -1.402 . . . . 0.0 107.215 -172.656 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -32.69 -44.16 0.1 Allowed 'General case' 0 C--O 1.225 -0.235 0 C-N-CA 128.62 2.768 . . . . 0.0 114.203 -173.513 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.84 -59.69 0.17 Allowed 'General case' 0 CA--C 1.527 0.096 0 C-N-CA 125.882 1.673 . . . . 0.0 113.732 178.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 74.1 tt0 -65.86 -38.44 88.83 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.742 0.306 . . . . 0.0 110.695 -173.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 53' ' ' ILE . . . . . 0.524 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.1 mp -63.5 -53.43 45.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 N-CA-C 106.893 -1.521 . . . . 0.0 106.893 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 78.8 t -56.02 -44.36 78.19 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 C-N-CA 124.226 1.011 . . . . 0.0 110.04 179.606 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -56.1 -53.91 51.38 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 118.779 0.718 . . . . 0.0 110.759 173.117 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 66.6 mt -53.56 -41.29 66.33 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 119.082 -0.485 . . . . 0.0 111.374 178.84 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 25.9 mmt -67.57 -61.36 1.93 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.896 0.771 . . . . 0.0 109.646 176.472 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -42.8 -43.88 4.19 Favored 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 127.441 2.296 . . . . 0.0 111.437 -177.731 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -39.64 -48.66 2.14 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.397 1.079 . . . . 0.0 112.302 176.115 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 10.2 mp -63.02 -48.59 78.11 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 -176.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -62.83 -45.32 93.17 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 122.825 0.45 . . . . 0.0 110.606 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 45.4 ttm-85 -55.73 -51.95 65.59 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 123.6 0.76 . . . . 0.0 109.198 176.724 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -84.32 59.74 5.57 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.079 0.552 . . . . 0.0 110.586 -176.675 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 4.5 mtmp? -71.83 73.68 0.84 Allowed 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 169.305 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 44.3 m-20 50.69 50.71 18.4 Favored 'General case' 0 CA--C 1.527 0.085 0 C-N-CA 125.497 1.519 . . . . 0.0 110.953 179.329 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -150.03 144.12 25.59 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 177.473 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -80.5 132.87 35.75 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 174.44 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 5.6 m -78.98 140.93 16.1 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 174.67 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 18.6 p30 -82.89 172.82 12.41 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 123.556 0.742 . . . . 0.0 110.902 175.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -44.34 -60.18 2.05 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.001 0.92 . . . . 0.0 112.56 176.049 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 50.4 tp60 -62.72 -35.51 79.98 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 119.381 0.991 . . . . 0.0 110.925 -175.26 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 57.9 mm-40 -60.82 -47.75 84.91 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 119.032 0.833 . . . . 0.0 111.094 173.54 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -53.25 -49.22 67.32 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 122.004 -0.435 . . . . 0.0 110.145 172.549 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 0.449 ' CG2' ' CG2' ' A' ' 74' ' ' ILE . 29.8 mm -57.83 -39.21 69.94 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 O-C-N 121.735 -0.603 . . . . 0.0 110.66 176.239 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 57.8 m -63.87 -41.09 97.83 Favored 'General case' 0 C--O 1.227 -0.125 0 O-C-N 121.587 -0.695 . . . . 0.0 110.106 177.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 32.0 t80 -54.32 -53.16 57.64 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 173.657 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 75.9 mt -62.4 -42.28 99.31 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 178.53 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.32 -42.39 94.07 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 110.718 -0.953 . . . . 0.0 110.718 -177.684 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.6 -46.76 88.45 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 123.41 0.684 . . . . 0.0 109.886 174.238 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 10.2 tp -51.51 -54.59 25.63 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 174.582 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -53.08 -52.5 58.38 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.899 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 28.8 mtt -50.7 -55.69 15.4 Favored 'General case' 0 CA--C 1.526 0.049 0 C-N-CA 123.825 0.85 . . . . 0.0 111.347 174.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 49.0 mt -63.12 -47.37 92.8 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.327 0 CA-C-O 118.105 -0.95 . . . . 0.0 110.433 -169.266 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.475 0.0 OUTLIER -83.48 -39.69 20.18 Favored 'General case' 0 C--N 1.347 0.463 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 179.818 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 16.4 m-80 -82.37 65.98 7.75 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 107.294 -1.373 . . . . 0.0 107.294 169.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -43.96 -37.86 3.15 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.543 1.137 . . . . 0.0 112.701 -174.836 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.27 -48.46 0.23 Allowed 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 127.024 2.13 . . . . 0.0 113.346 169.748 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 97.3 mt -63.67 -33.32 75.38 Favored 'General case' 0 CA--C 1.528 0.104 0 N-CA-C 112.573 0.583 . . . . 0.0 112.573 -176.356 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 29.7 mtmm -81.93 -43.18 18.44 Favored 'General case' 0 N--CA 1.455 -0.206 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 174.324 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.175 0 CA-C-O 117.17 -1.905 . . . . 0.0 110.712 -175.019 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.734 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -78.86 68.62 4.86 Favored 'General case' 0 C--O 1.234 0.259 0 O-C-N 122.089 -0.382 . . . . 0.0 111.317 -175.118 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.4 m -52.67 157.91 2.39 Favored Pre-proline 0 CA--C 1.534 0.353 0 C-N-CA 123.991 0.916 . . . . 0.0 110.266 172.183 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_exo -40.09 -52.03 2.98 Favored 'Trans proline' 0 N--CA 1.459 -0.511 0 C-N-CA 124.038 3.158 . . . . 0.0 113.82 -179.343 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 5' ' ' LEU . 5.6 mt -54.05 -60.41 3.36 Favored 'General case' 0 C--O 1.225 -0.207 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 173.773 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -55.77 -40.11 72.14 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-O 121.004 0.43 . . . . 0.0 110.708 -175.777 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -64.96 -51.63 60.72 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.356 1.062 . . . . 0.0 110.144 -179.625 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.05 -46.77 87.4 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.221 1.008 . . . . 0.0 110.901 178.453 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 69.1 mt -51.94 -55.07 10.83 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 170.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.23 -47.88 20.95 Favored Glycine 0 CA--C 1.527 0.834 0 C-N-CA 125.148 1.356 . . . . 0.0 112.033 176.372 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.9 mt -55.0 -53.43 55.85 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.612 0.765 . . . . 0.0 110.986 174.46 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -59.33 -45.0 92.54 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 121.582 -0.699 . . . . 0.0 111.792 179.454 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.479 HD11 ' HB1' ' B' ' 81' ' ' ALA . 83.9 mt -55.72 -55.6 16.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 C-N-CA 123.714 0.806 . . . . 0.0 109.819 175.177 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -52.74 -51.97 41.32 Favored Glycine 0 CA--C 1.521 0.447 0 N-CA-C 109.724 -1.35 . . . . 0.0 109.724 -177.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.44 HG21 HD11 ' B' ' 5' ' ' LEU . 3.2 mm -56.71 -47.31 82.7 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 CA-C-O 119.332 -0.366 . . . . 0.0 110.634 179.057 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.4 ' HB2' ' CE2' ' A' ' 73' ' ' TYR . 73.7 t80 -53.03 -60.44 3.29 Favored 'General case' 0 C--N 1.339 0.14 0 CA-C-N 118.126 0.421 . . . . 0.0 110.055 175.388 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -60.55 -34.69 74.52 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 118.987 -0.53 . . . . 0.0 111.19 -171.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.3 ttpp -52.72 -37.9 59.92 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.134 0.574 . . . . 0.0 111.442 -179.258 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -97.27 -58.48 2.0 Favored 'General case' 0 C--O 1.227 -0.116 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 175.377 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.8 t -50.05 -35.7 26.12 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.369 1.068 . . . . 0.0 111.733 -173.727 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -39.83 -39.05 1.27 Allowed Glycine 0 CA--C 1.53 0.982 0 C-N-CA 125.362 1.458 . . . . 0.0 114.336 172.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 41.8 pttt -76.72 -18.78 58.3 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.271 1.035 . . . . 0.0 112.818 -174.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 60.1 mm-40 -76.25 148.61 37.49 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 179.292 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -55.21 -64.09 4.68 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 110.624 -0.99 . . . . 0.0 110.624 -178.478 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -79.34 75.47 5.92 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 107.094 -1.447 . . . . 0.0 107.094 169.507 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -54.34 -13.72 0.98 Allowed 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 115.022 1.489 . . . . 0.0 115.022 -172.144 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 9.9 m80 -77.81 -6.04 52.82 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.333 1.053 . . . . 0.0 110.708 176.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 31.6 p -134.5 161.8 34.04 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 125.987 1.715 . . . . 0.0 109.64 -179.498 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -158.43 177.55 11.13 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.816 1.247 . . . . 0.0 108.059 174.028 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 8.5 t -139.13 -169.46 2.66 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 119.861 1.209 . . . . 0.0 112.282 -175.281 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 41.9 pttt -41.44 -54.07 3.2 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 127.279 2.231 . . . . 0.0 113.61 -169.596 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -53.62 -51.94 61.47 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.064 0.546 . . . . 0.0 110.267 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 14.6 mp0 -64.92 -41.87 95.19 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 -178.463 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 41.8 mt -62.07 -47.38 84.91 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 118.544 0.611 . . . . 0.0 111.528 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -61.51 -49.94 74.72 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 176.377 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 78.3 tt0 -48.82 -54.89 13.32 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.168 0.987 . . . . 0.0 110.574 175.685 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.5 mt -48.41 -75.26 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 126.007 1.723 . . . . 0.0 109.022 174.68 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 15.6 tt -55.26 -47.05 78.16 Favored 'Isoleucine or valine' 0 C--N 1.341 0.235 0 CA-C-N 118.427 0.558 . . . . 0.0 111.268 -169.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.3 tt0 -52.23 -47.79 65.5 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 123.64 0.776 . . . . 0.0 111.37 -177.641 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 73.1 mttt -81.01 -62.58 1.62 Allowed 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 121.733 0.778 . . . . 0.0 109.506 -179.059 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -55.87 -36.33 67.47 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 114.842 -1.072 . . . . 0.0 111.882 -169.562 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 85.1 mt -119.28 62.25 0.8 Allowed 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 124.842 1.257 . . . . 0.0 107.743 171.155 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.4 t -69.23 53.47 0.1 Allowed 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.063 0.945 . . . . 0.0 110.848 169.229 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 62.8 mt -74.4 80.72 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -49.83 -36.19 25.82 Favored Glycine 0 CA--C 1.53 0.977 0 C-N-CA 124.247 0.927 . . . . 0.0 111.842 176.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.7 m -61.45 -17.5 54.67 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.732 1.213 . . . . 0.0 113.946 176.709 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt 49.31 60.65 3.62 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 125.442 1.497 . . . . 0.0 111.007 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 56.8 mt -66.81 77.48 0.12 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.615 1.166 . . . . 0.0 111.687 -178.628 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? 83.09 151.01 0.09 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 126.961 2.104 . . . . 0.0 111.464 172.443 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -42.08 -39.55 2.0 Allowed 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 127.822 2.449 . . . . 0.0 114.412 -169.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.84 -60.39 0.16 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.804 1.642 . . . . 0.0 114.1 -174.828 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -65.29 -42.68 92.89 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 122.958 0.503 . . . . 0.0 111.137 -175.538 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.545 HD12 ' H ' ' A' ' 53' ' ' ILE . 1.2 mp -60.01 -53.01 54.5 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 N-CA-C 106.876 -1.528 . . . . 0.0 106.876 -178.921 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 72.1 t -54.13 -55.35 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 CA-C-N 115.523 -0.762 . . . . 0.0 108.976 178.383 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -47.26 -54.48 10.78 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 118.489 0.586 . . . . 0.0 111.724 178.893 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 25.8 mt -51.55 -41.11 60.87 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 -177.255 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -80.79 -65.26 1.03 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.343 0.657 . . . . 0.0 110.37 178.698 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -37.91 -42.43 0.62 Allowed 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 127.38 2.272 . . . . 0.0 112.139 179.712 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -38.22 -49.27 1.36 Allowed 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 124.671 1.188 . . . . 0.0 112.546 175.65 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.8 pp -58.73 -41.68 87.02 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.459 0.572 . . . . 0.0 111.148 -175.345 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -75.66 -46.28 32.3 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 123.661 0.784 . . . . 0.0 109.967 -178.798 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 59.7 ttm-85 -50.28 -47.78 55.21 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.831 0.852 . . . . 0.0 110.291 176.495 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -75.91 -60.06 2.49 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 22.3 ttpp 48.11 48.37 18.44 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.695 0.76 . . . . 0.0 109.4 -170.111 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 69.41 -2.6 1.83 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.227 1.811 . . . . 0.0 114.405 -179.458 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -70.22 145.37 51.45 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.633 1.106 . . . . 0.0 108.895 173.273 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -85.92 119.79 26.62 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 172.039 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.6 m -79.65 145.63 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 172.678 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.9 p-10 -88.54 177.88 6.67 Favored 'General case' 0 C--O 1.231 0.086 0 C-N-CA 122.832 0.453 . . . . 0.0 110.825 175.192 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -42.6 -59.73 1.8 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.684 0.794 . . . . 0.0 112.241 172.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 61.6 tp60 -60.75 -37.0 80.34 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 119.294 0.952 . . . . 0.0 111.683 -175.51 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -67.97 -37.43 81.52 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.248 -0.908 . . . . 0.0 111.217 176.466 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.4 ' CE2' ' HB2' ' A' ' 16' ' ' PHE . 0.4 OUTLIER -58.0 -48.43 80.04 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.12 -0.988 . . . . 0.0 109.474 169.344 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 30.6 mm -58.76 -32.8 47.53 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 123.171 0.589 . . . . 0.0 110.497 175.558 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 56.0 m -69.86 -38.96 76.6 Favored 'General case' 0 C--O 1.225 -0.216 0 O-C-N 121.504 -0.747 . . . . 0.0 110.621 174.052 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -59.16 -55.73 31.28 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.56 0.618 . . . . 0.0 109.366 174.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 32.1 mt -56.8 -46.61 81.46 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 120.711 0.291 . . . . 0.0 110.931 175.081 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -58.18 -44.3 94.93 Favored Glycine 0 CA--C 1.525 0.673 0 C-N-CA 124.346 0.974 . . . . 0.0 111.448 -178.11 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.58 -47.43 69.75 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.45 0.7 . . . . 0.0 109.899 178.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -49.98 -54.3 20.86 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.446 0.641 . . . . 0.0 109.565 173.831 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -53.15 -55.57 23.07 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 124.702 1.201 . . . . 0.0 110.968 177.314 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 40.2 ttm -52.33 -52.12 54.96 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 124.775 1.23 . . . . 0.0 110.524 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 56.6 mt -62.81 -51.68 68.95 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-O 118.088 -0.958 . . . . 0.0 109.706 -172.674 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.427 0.0 OUTLIER -81.51 -32.31 32.42 Favored 'General case' 0 C--N 1.346 0.436 0 N-CA-C 114.667 1.358 . . . . 0.0 114.667 -176.392 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -80.36 76.48 7.17 Favored 'General case' 0 CA--C 1.521 -0.157 0 O-C-N 120.714 -1.242 . . . . 0.0 108.615 175.201 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -35.07 -49.83 0.48 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.522 1.529 . . . . 0.0 111.689 177.591 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -38.33 -43.78 0.84 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 126.893 2.077 . . . . 0.0 114.088 177.007 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 55.2 mt -61.96 -38.17 87.49 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 119.432 -0.318 . . . . 0.0 111.339 -178.47 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 9.8 mtmp? -79.87 55.06 1.99 Allowed 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.31 0.644 . . . . 0.0 111.635 -169.386 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.246 0 CA-C-O 116.731 -2.149 . . . . 0.0 110.107 176.245 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 28.0 ttt . . . . . 0 N--CA 1.474 0.758 0 CA-C-O 121.193 0.521 . . . . 0.0 110.045 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -73.02 78.6 1.19 Allowed 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 121.137 0.494 . . . . 0.0 110.581 -179.179 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 4.5 t -45.71 150.43 0.95 Allowed Pre-proline 0 CA--C 1.535 0.393 0 C-N-CA 124.292 1.037 . . . . 0.0 110.521 169.316 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo -43.56 -42.73 11.19 Favored 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 123.083 2.522 . . . . 0.0 112.097 168.596 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.44 HD11 HG21 ' A' ' 15' ' ' ILE . 5.0 mt -66.57 -43.06 86.0 Favored 'General case' 0 C--O 1.223 -0.331 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 174.134 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -57.07 -46.47 82.48 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 119.015 0.825 . . . . 0.0 109.407 177.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 -58.99 -52.73 64.49 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.57 0.748 . . . . 0.0 110.805 175.71 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.14 -46.76 85.73 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.301 0.64 . . . . 0.0 112.063 -175.57 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 73.9 mt -54.5 -53.21 32.95 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 N-CA-C 107.886 -1.154 . . . . 0.0 107.886 170.603 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.25 -46.27 15.99 Favored Glycine 0 CA--C 1.528 0.846 0 C-N-CA 124.64 1.114 . . . . 0.0 112.067 175.559 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 mt -58.23 -57.37 13.18 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.918 0.887 . . . . 0.0 110.918 174.843 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.07 -43.74 87.14 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.264 0.938 . . . . 0.0 111.669 -178.405 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 59.3 mt -56.35 -55.35 19.44 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.156 0 C-N-CA 123.623 0.769 . . . . 0.0 110.0 173.259 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.89 -49.15 63.28 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 110.566 -1.014 . . . . 0.0 110.566 -177.131 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 11.2 mm -53.06 -49.37 50.28 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 C-N-CA 123.454 0.701 . . . . 0.0 109.871 175.05 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 37.7 t80 -56.8 -52.43 65.07 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 121.805 -0.559 . . . . 0.0 110.768 176.733 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -58.57 -38.3 77.58 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 124.687 1.195 . . . . 0.0 111.106 -174.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 61.8 tttm -57.76 -25.82 60.99 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.933 1.293 . . . . 0.0 112.497 -179.352 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 56.2 m-85 -117.1 -62.22 1.61 Allowed 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.372 0.669 . . . . 0.0 109.903 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -64.86 -48.93 72.53 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 124.164 0.985 . . . . 0.0 110.162 -176.6 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.89 56.6 3.9 Favored Glycine 0 C--N 1.339 0.712 0 C-N-CA 124.257 0.932 . . . . 0.0 111.969 -172.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 36.5 mtmt -146.47 -44.94 0.19 Allowed 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 127.556 2.343 . . . . 0.0 106.806 176.063 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 63.8 mt-10 -60.68 147.84 40.67 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 168.129 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -52.64 -43.44 59.48 Favored Glycine 0 CA--C 1.53 1.014 0 N-CA-C 111.517 -0.633 . . . . 0.0 111.517 -178.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -78.96 59.66 2.7 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.459 1.104 . . . . 0.0 110.134 177.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -50.51 -27.6 6.91 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.102 1.361 . . . . 0.0 113.791 -173.467 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 12.9 t-80 -76.92 -5.06 47.01 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.158 0.583 . . . . 0.0 111.976 -175.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -138.54 158.75 43.66 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 125.195 1.398 . . . . 0.0 111.316 -169.052 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.47 176.11 12.0 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 125.388 1.475 . . . . 0.0 108.212 171.397 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 7.3 t -135.59 -166.27 1.82 Allowed 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.731 1.151 . . . . 0.0 113.304 177.664 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -38.67 -65.12 0.38 Allowed 'General case' 0 N--CA 1.458 -0.064 0 C-N-CA 128.19 2.596 . . . . 0.0 113.175 -169.581 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 36.3 ttpt -51.96 -50.3 61.49 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 123.465 0.706 . . . . 0.0 110.238 -175.713 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -61.36 -43.97 97.97 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 123.25 0.62 . . . . 0.0 110.15 -177.616 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 34.7 mt -62.4 -50.89 69.73 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 118.187 0.449 . . . . 0.0 111.546 177.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -61.93 -42.3 98.94 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 -178.211 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -56.42 -65.33 0.62 Allowed 'General case' 0 C--O 1.22 -0.476 0 CA-C-O 118.515 -0.755 . . . . 0.0 109.13 169.51 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 5.5 mt -35.04 -62.98 0.35 Allowed 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 125.321 1.449 . . . . 0.0 111.687 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 15.9 tt -60.49 -50.78 79.0 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 C-N-CA 120.297 -0.561 . . . . 0.0 110.306 -175.074 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 16.0 tt0 -62.11 -41.07 97.86 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.317 0.508 . . . . 0.0 112.151 -176.301 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 6.2 mmpt? -69.85 -54.13 14.92 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.637 1.175 . . . . 0.0 109.473 -177.306 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 -83.43 -35.54 24.92 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.58 -0.736 . . . . 0.0 112.682 -167.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 47.1 mt -85.03 87.32 7.36 Favored 'General case' 0 C--N 1.339 0.14 0 CA-C-N 119.36 0.982 . . . . 0.0 108.809 170.834 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 64.2 p -78.62 55.61 1.68 Allowed 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 177.139 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 55.3 mt -86.0 -59.0 3.0 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 C-N-CA 124.742 1.217 . . . . 0.0 108.763 -173.711 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.31 -65.68 1.29 Allowed Glycine 0 CA--C 1.53 0.981 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 -176.711 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 49.2 m -69.92 74.17 0.44 Allowed 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 124.145 0.978 . . . . 0.0 109.319 170.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 26.8 mtmm -47.7 96.31 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.983 1.713 . . . . 0.0 111.474 -178.569 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 72.5 mt -40.28 -46.7 2.35 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 126.806 2.043 . . . . 0.0 113.674 -173.476 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -157.95 170.0 23.3 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 -178.654 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -36.41 -42.45 0.33 Allowed 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 126.868 2.067 . . . . 0.0 113.095 173.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.35 -58.15 0.15 Allowed 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 126.541 1.936 . . . . 0.0 113.972 -178.626 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 65.0 tt0 -68.34 -40.41 81.57 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 121.066 0.46 . . . . 0.0 110.878 -172.833 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 53' ' ' ILE . . . . . 0.64 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.9 mp -62.99 -52.5 58.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 N-CA-C 106.865 -1.531 . . . . 0.0 106.865 179.378 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 72.0 t -54.85 -46.63 75.49 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 C-N-CA 124.362 1.065 . . . . 0.0 109.829 178.615 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.42 -53.61 54.07 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 119.402 1.001 . . . . 0.0 110.565 175.404 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 39.9 mt -53.22 -41.47 65.38 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 118.972 -0.537 . . . . 0.0 111.494 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 27.8 mmt -70.21 -65.14 0.76 Allowed 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 118.716 0.689 . . . . 0.0 109.643 175.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -43.71 -35.02 1.67 Allowed 'General case' 0 CA--C 1.518 -0.282 0 C-N-CA 128.356 2.662 . . . . 0.0 112.192 -174.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -37.85 -49.97 1.24 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.0 0.92 . . . . 0.0 111.87 173.484 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.9 pp -61.34 -43.48 98.79 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.366 0.53 . . . . 0.0 111.331 -177.751 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -69.6 -41.11 76.19 Favored 'General case' 0 C--O 1.226 -0.183 0 C-N-CA 123.941 0.896 . . . . 0.0 110.113 -177.71 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 14.2 ttm180 -62.73 -48.5 78.96 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 124.76 1.224 . . . . 0.0 110.033 179.55 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -77.64 -41.59 37.83 Favored 'General case' 0 C--O 1.226 -0.143 0 CA-C-N 116.713 -0.221 . . . . 0.0 111.248 -175.401 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 84.7 mttt 55.72 24.85 7.62 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.197 0.999 . . . . 0.0 111.735 -169.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 64.32 36.47 9.14 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.967 1.707 . . . . 0.0 112.221 -172.103 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -122.91 163.94 19.41 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 106.161 -1.792 . . . . 0.0 106.161 166.394 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 16.3 mp0 -75.51 144.68 41.86 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 123.171 0.589 . . . . 0.0 110.839 178.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 25.2 m -101.56 151.22 5.65 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 N-CA-C 106.698 -1.593 . . . . 0.0 106.698 167.554 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 10.2 p30 -94.67 171.86 8.53 Favored 'General case' 0 C--O 1.231 0.129 0 C-N-CA 123.404 0.682 . . . . 0.0 110.624 176.516 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -35.5 -59.87 0.53 Allowed 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.351 1.461 . . . . 0.0 113.486 177.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -66.53 -31.77 72.71 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 120.429 1.468 . . . . 0.0 111.616 -174.383 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.34 -36.44 68.81 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 121.271 -0.893 . . . . 0.0 109.822 177.939 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -56.29 -53.77 53.29 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 168.4 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 19.9 mm -53.74 -42.0 49.96 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.406 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 177.806 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 70.4 m -63.06 -27.21 69.24 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 119.018 0.827 . . . . 0.0 111.831 177.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 10.7 t80 -58.35 -52.84 63.92 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.459 1.027 . . . . 0.0 108.321 170.131 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 48.8 mt -64.61 -41.31 96.29 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.861 0.865 . . . . 0.0 111.668 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -70.78 -42.27 61.77 Favored Glycine 0 CA--C 1.526 0.749 0 C-N-CA 124.408 1.004 . . . . 0.0 110.658 -175.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.21 -43.91 76.96 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 121.924 -0.75 . . . . 0.0 110.079 175.543 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 12.1 tp -49.61 -56.8 8.71 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 121.281 0.563 . . . . 0.0 109.774 171.159 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 81' ' ' ALA . . . . . 0.479 ' HB1' HD11 ' A' ' 13' ' ' ILE . . . -50.15 -53.67 25.99 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 124.391 1.076 . . . . 0.0 110.32 178.188 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 53.7 ttm -54.45 -50.07 68.55 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.937 0.895 . . . . 0.0 111.129 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 98.1 mt -63.95 -55.01 24.63 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 CA-C-O 118.48 -0.772 . . . . 0.0 110.578 -176.154 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.45 0.1 OUTLIER -76.69 -35.2 58.04 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.419 1.009 . . . . 0.0 113.284 -175.029 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 26.0 m-80 -82.55 72.79 9.61 Favored 'General case' 0 N--CA 1.465 0.284 0 O-C-N 120.63 -1.294 . . . . 0.0 107.97 169.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -46.89 -31.48 3.14 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.968 0.907 . . . . 0.0 113.051 -176.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -42.15 -41.88 2.81 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.879 1.272 . . . . 0.0 113.106 172.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 84.2 mt -68.25 -24.4 64.89 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.161 0.584 . . . . 0.0 112.424 -179.3 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 9.8 mtmp? -83.28 -51.98 6.97 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 172.119 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.218 0 CA-C-O 117.0 -2.0 . . . . 0.0 112.502 178.864 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.0 mtm . . . . . 0 N--CA 1.474 0.727 0 CA-C-O 120.481 0.181 . . . . 0.0 110.776 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -78.4 67.14 4.12 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 120.868 0.366 . . . . 0.0 110.523 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.59 165.84 2.07 Favored Pre-proline 0 CA--C 1.538 0.493 0 C-N-CA 124.282 1.033 . . . . 0.0 111.143 176.922 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_exo -46.26 -47.98 13.99 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 123.367 2.711 . . . . 0.0 113.054 178.39 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.418 HD23 ' HA ' ' A' ' 5' ' ' LEU . 6.1 mt -56.95 -49.84 74.46 Favored 'General case' 0 C--N 1.34 0.168 0 CA-C-O 119.472 -0.299 . . . . 0.0 111.428 175.196 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -58.97 -45.04 91.52 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-N 118.248 0.476 . . . . 0.0 109.857 -178.352 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -59.43 -49.99 75.67 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 122.9 0.48 . . . . 0.0 110.239 178.55 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.69 -45.87 84.8 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.416 0.687 . . . . 0.0 111.666 -177.152 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 71.5 mt -54.72 -50.94 56.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 171.414 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.74 -49.44 22.09 Favored Glycine 0 CA--C 1.526 0.771 0 C-N-CA 125.012 1.291 . . . . 0.0 111.527 174.835 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.3 mt -54.79 -56.67 16.89 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 117.576 0.688 . . . . 0.0 110.889 173.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -57.28 -42.59 81.93 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 119.203 0.91 . . . . 0.0 111.72 -178.366 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 95.6 mt -59.81 -54.11 39.11 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 123.518 0.727 . . . . 0.0 110.908 174.542 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.4 -50.59 61.63 Favored Glycine 0 CA--C 1.522 0.511 0 N-CA-C 109.883 -1.287 . . . . 0.0 109.883 -177.731 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 9.9 mm -50.87 -51.76 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 C-N-CA 123.92 0.888 . . . . 0.0 109.968 173.672 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -52.24 -61.57 2.19 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 178.212 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 6.0 m-70 -65.33 -23.87 67.11 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 113.958 1.096 . . . . 0.0 113.958 -172.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 62.4 tttm -50.24 -31.94 15.35 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 118.766 0.712 . . . . 0.0 111.147 169.462 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -113.0 -33.54 6.01 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.482 0.713 . . . . 0.0 112.683 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 77.4 p -89.12 -32.08 17.68 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 119.891 1.223 . . . . 0.0 113.204 -178.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -79.96 50.82 3.98 Favored Glycine 0 C--N 1.334 0.471 0 C-N-CA 124.004 0.812 . . . . 0.0 112.232 -168.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 5.1 mmmm -115.99 -48.21 2.75 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 123.424 0.69 . . . . 0.0 111.795 -168.537 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -161.34 167.21 26.24 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 179.024 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 49.12 -124.48 13.33 Favored Glycine 0 CA--C 1.528 0.887 0 C-N-CA 124.775 1.179 . . . . 0.0 112.818 172.174 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -78.9 71.47 5.36 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.195 0.598 . . . . 0.0 109.39 -174.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 65.0 mttm -56.43 -15.86 4.84 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.18 0.992 . . . . 0.0 113.063 -179.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 9.7 t-80 -77.18 -4.33 44.06 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.627 0.771 . . . . 0.0 111.798 175.197 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 46.0 p -130.22 166.57 20.02 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 125.014 1.325 . . . . 0.0 111.452 -179.093 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -161.16 -177.19 5.9 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.377 1.471 . . . . 0.0 107.616 168.57 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.4 p -139.25 176.84 8.37 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 119.59 1.086 . . . . 0.0 112.805 -173.74 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 19.8 pttt -30.84 -53.78 0.19 Allowed 'General case' 0 N--CA 1.457 -0.099 0 C-N-CA 127.646 2.378 . . . . 0.0 114.874 179.057 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 24.8 ttpp -58.07 -49.12 78.03 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 118.888 0.767 . . . . 0.0 110.743 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.4 mp0 -64.07 -36.02 82.63 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 122.685 0.394 . . . . 0.0 110.619 178.345 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 45.2 mt -68.07 -47.6 67.85 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.617 0.644 . . . . 0.0 111.204 179.117 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -56.44 -47.38 79.22 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 173.63 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -53.81 -58.08 8.54 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-O 119.167 -0.445 . . . . 0.0 110.975 172.77 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.0 mt -45.52 -61.18 1.79 Allowed 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 124.291 1.036 . . . . 0.0 110.406 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 14.7 tt -61.06 -50.27 81.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 C-N-CA 120.507 -0.477 . . . . 0.0 109.858 -175.533 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -61.85 -53.18 59.39 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 121.493 -0.754 . . . . 0.0 112.305 -175.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -67.02 -59.03 3.82 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.988 0.915 . . . . 0.0 109.39 -178.315 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -79.78 -46.67 16.56 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 119.262 -0.399 . . . . 0.0 111.742 -168.142 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 20.1 mt -84.18 61.36 6.47 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 119.001 0.819 . . . . 0.0 109.41 174.166 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.3 t -73.58 69.25 1.24 Allowed 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 105.919 -1.882 . . . . 0.0 105.919 167.402 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 13.1 tt -78.73 -33.6 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 C-N-CA 125.359 1.464 . . . . 0.0 111.635 -168.342 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 134.51 -154.99 21.69 Favored Glycine 0 CA--C 1.522 0.496 0 N-CA-C 106.935 -2.466 . . . . 0.0 106.935 -170.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.5 p -75.95 67.53 2.33 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 117.725 0.762 . . . . 0.0 110.504 -179.264 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.404 ' HB3' HD11 ' A' ' 53' ' ' ILE . 34.0 mtmm 49.06 67.01 0.94 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.042 1.337 . . . . 0.0 111.29 173.671 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 11.7 mt -67.58 85.54 0.19 Allowed 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -169.838 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? 89.23 145.12 0.04 OUTLIER 'General case' 0 C--O 1.235 0.315 0 C-N-CA 127.936 2.494 . . . . 0.0 111.249 171.046 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -36.61 -43.98 0.43 Allowed 'General case' 0 C--O 1.225 -0.235 0 C-N-CA 128.002 2.521 . . . . 0.0 113.387 -169.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -30.33 -56.47 0.19 Allowed 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 125.793 1.637 . . . . 0.0 113.382 176.346 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.9 tm-20 -64.89 -41.52 95.55 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.64 0.734 . . . . 0.0 110.384 -173.707 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.544 HD12 ' H ' ' A' ' 53' ' ' ILE . 1.1 mp -66.28 -52.74 44.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 N-CA-C 107.053 -1.462 . . . . 0.0 107.053 -177.784 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 78.6 t -52.89 -41.06 38.72 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 C-N-CA 124.64 1.176 . . . . 0.0 109.777 175.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.7 mptp? -60.53 -51.88 67.54 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 118.988 0.813 . . . . 0.0 110.851 174.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 85.6 mt -52.08 -43.0 63.65 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 119.316 -0.373 . . . . 0.0 110.872 177.036 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 24.7 mmt -68.75 -62.42 1.39 Allowed 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 118.475 0.579 . . . . 0.0 109.94 178.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -45.26 -40.61 7.71 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 127.093 2.157 . . . . 0.0 111.498 -177.13 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -40.94 -47.31 2.98 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.714 0.806 . . . . 0.0 112.462 175.029 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.1 mp -63.39 -53.86 45.87 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 -178.596 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -60.95 -34.11 74.23 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 123.625 0.77 . . . . 0.0 111.279 -178.06 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.9 ttm180 -65.51 -55.68 16.52 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 173.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -85.16 67.26 10.11 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 123.397 0.679 . . . . 0.0 109.915 -175.675 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 49.3 mttp -73.0 65.99 0.78 Allowed 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 171.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 49.97 48.01 22.48 Favored 'General case' 0 CA--C 1.528 0.125 0 C-N-CA 125.321 1.448 . . . . 0.0 110.96 -173.564 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 26.3 mm-40 -138.76 152.03 47.6 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 125.59 1.556 . . . . 0.0 106.924 172.675 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -82.28 152.7 26.22 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.38 0.672 . . . . 0.0 109.593 171.613 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 11.3 m -103.07 144.31 14.01 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 170.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -86.29 168.4 13.93 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 122.835 0.454 . . . . 0.0 111.158 174.25 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -34.4 -61.31 0.39 Allowed 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 124.547 1.139 . . . . 0.0 112.718 172.566 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 48.5 tp60 -63.22 -31.66 72.86 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 119.791 1.178 . . . . 0.0 112.072 -174.191 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -69.68 -42.43 74.14 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 121.305 -0.872 . . . . 0.0 110.022 176.489 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -54.92 -51.38 66.26 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 170.769 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 26.9 mm -56.25 -40.26 64.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 C-N-CA 123.158 0.583 . . . . 0.0 110.117 176.318 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 86.2 m -64.6 -39.01 92.96 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 118.926 0.784 . . . . 0.0 110.961 176.78 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 44.9 t80 -54.95 -53.54 54.29 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 172.27 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 58.7 mt -59.14 -42.18 90.03 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.962 -0.461 . . . . 0.0 111.83 176.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -62.41 -45.86 95.05 Favored Glycine 0 CA--C 1.525 0.709 0 C-N-CA 124.177 0.894 . . . . 0.0 110.959 -178.436 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.89 -44.68 84.6 Favored 'General case' 0 N--CA 1.45 -0.458 0 O-C-N 122.182 -0.599 . . . . 0.0 110.061 177.569 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 13.1 tp -51.18 -57.24 9.28 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.325 0.583 . . . . 0.0 109.899 173.538 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -48.75 -56.17 9.38 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 114.812 -1.085 . . . . 0.0 109.942 177.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 46.7 ttm -52.33 -54.44 31.55 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 123.916 0.886 . . . . 0.0 111.071 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 42.1 mt -63.49 -45.75 96.98 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 CA-C-O 118.302 -0.856 . . . . 0.0 110.856 -171.42 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.446 0.1 OUTLIER -83.05 -30.93 27.66 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 -179.844 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 24.3 m-80 -79.8 71.95 6.49 Favored 'General case' 0 C--O 1.236 0.355 0 O-C-N 120.926 -1.109 . . . . 0.0 108.433 170.348 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -65.0 74.18 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.572 1.549 . . . . 0.0 109.431 175.206 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -171.89 -47.38 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 128.684 2.794 . . . . 0.0 106.851 -169.792 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 55.7 mt -58.58 -43.28 89.4 Favored 'General case' 0 C--N 1.343 0.306 0 N-CA-C 108.412 -0.958 . . . . 0.0 108.412 168.692 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -67.49 71.37 0.12 Allowed 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 168.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.221 0 CA-C-O 117.642 -1.644 . . . . 0.0 110.267 -169.922 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 3.7 mpp? . . . . . 0 N--CA 1.472 0.659 0 N-CA-C 110.396 -0.224 . . . . 0.0 110.396 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -74.09 75.92 1.74 Allowed 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 175.255 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -49.42 157.31 0.94 Allowed Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 125.459 1.504 . . . . 0.0 110.35 173.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -50.67 -48.42 20.65 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 122.911 2.407 . . . . 0.0 112.213 -174.45 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.7 mt -55.26 -52.82 62.17 Favored 'General case' 0 C--O 1.225 -0.231 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 172.146 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -58.68 -39.67 81.36 Favored 'General case' 0 C--O 1.225 -0.186 0 CA-C-N 118.243 0.474 . . . . 0.0 110.274 -175.76 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -64.33 -50.99 65.62 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.503 1.121 . . . . 0.0 110.483 177.715 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.53 -45.44 94.15 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 121.443 0.639 . . . . 0.0 111.128 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 67.1 mt -53.19 -53.97 20.11 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 169.922 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.6 -46.96 18.08 Favored Glycine 0 CA--C 1.526 0.775 0 C-N-CA 125.368 1.461 . . . . 0.0 111.986 176.249 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.7 mt -55.45 -56.07 24.4 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 117.635 0.717 . . . . 0.0 110.742 173.562 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.4 mp -57.59 -42.94 84.21 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 118.973 0.806 . . . . 0.0 111.6 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 77.8 mt -56.97 -55.55 19.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 C-N-CA 123.336 0.654 . . . . 0.0 110.173 174.096 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.24 -49.68 62.69 Favored Glycine 0 CA--C 1.522 0.527 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 -177.643 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.5 mm -52.36 -48.71 44.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 C-N-CA 123.242 0.617 . . . . 0.0 110.137 174.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -56.51 -58.2 9.05 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 118.491 0.587 . . . . 0.0 110.47 176.433 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -54.61 -36.96 65.03 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 125.002 1.321 . . . . 0.0 111.208 -174.594 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -49.7 -34.43 18.7 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.062 0.945 . . . . 0.0 111.957 177.215 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 -106.62 -47.67 3.71 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.325 0.65 . . . . 0.0 110.837 178.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 22.7 t -63.64 -24.7 67.9 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.839 0.856 . . . . 0.0 112.422 -177.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -72.7 45.13 1.03 Allowed Glycine 0 CA--C 1.529 0.915 0 C-N-CA 124.267 0.936 . . . . 0.0 114.613 -172.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 25.0 mttm -142.18 -43.47 0.33 Allowed 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 118.554 1.177 . . . . 0.0 111.246 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -75.29 47.5 0.38 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.911 1.284 . . . . 0.0 114.369 -168.477 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 69.11 -74.68 0.36 Allowed Glycine 0 CA--C 1.529 0.922 0 C-N-CA 123.957 0.789 . . . . 0.0 112.155 174.247 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -89.92 105.45 17.81 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 172.138 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 30.0 mmtm -80.26 48.02 0.97 Allowed 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.568 0.747 . . . . 0.0 111.068 -171.761 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 45.6 t-80 -122.85 -10.47 8.24 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 125.691 1.597 . . . . 0.0 111.429 -174.167 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 41.3 p -135.04 163.05 30.75 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.899 1.28 . . . . 0.0 110.459 -175.164 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -159.87 164.95 33.14 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.527 0.731 . . . . 0.0 110.988 169.634 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 93.6 p -97.97 168.0 10.56 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.462 1.105 . . . . 0.0 113.641 -169.027 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 13.6 pttm -40.04 -53.19 2.43 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 126.781 2.032 . . . . 0.0 112.617 171.526 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -54.65 -45.45 73.82 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.39 0.676 . . . . 0.0 109.968 178.771 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -71.36 -35.79 71.24 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 123.485 0.714 . . . . 0.0 111.073 -176.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 13.3 mt -62.91 -49.35 75.13 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.224 0.92 . . . . 0.0 110.896 170.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -58.03 -46.31 85.52 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 178.824 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -54.08 -57.17 12.09 Favored 'General case' 0 C--O 1.222 -0.344 0 CA-C-O 119.001 -0.524 . . . . 0.0 110.663 171.095 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 9.3 mt -45.44 -60.73 2.0 Favored 'General case' 0 N--CA 1.457 -0.09 0 C-N-CA 123.625 0.77 . . . . 0.0 110.48 -178.772 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 19.8 tt -60.1 -52.98 54.87 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 120.287 -0.565 . . . . 0.0 110.118 -177.307 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -59.47 -49.88 76.07 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.739 -0.601 . . . . 0.0 112.535 -174.528 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.11 -53.79 10.14 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.696 0.798 . . . . 0.0 109.815 -176.785 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 51.8 mm-40 -81.68 -26.62 34.55 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 -167.535 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 23.9 mt -102.14 89.98 3.79 Favored 'General case' 0 CA--C 1.523 -0.083 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 169.243 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 63.0 p -76.44 61.43 1.72 Allowed 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 124.624 1.17 . . . . 0.0 108.783 179.196 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 15.2 mt -80.36 -60.29 2.34 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 177.517 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 69.2 -73.1 0.41 Allowed Glycine 0 CA--C 1.528 0.844 0 N-CA-C 110.425 -1.07 . . . . 0.0 110.425 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 15.6 m -61.31 99.93 0.12 Allowed 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 124.6 1.16 . . . . 0.0 108.467 169.564 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 25.0 mmtm -59.91 80.58 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.969 1.708 . . . . 0.0 111.93 -171.471 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . 0.258 4.3 pp -57.67 -35.67 70.87 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -169.014 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -164.05 153.51 14.18 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 119.254 0.933 . . . . 0.0 108.733 179.817 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -41.92 -40.05 2.03 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 128.137 2.575 . . . . 0.0 114.162 -171.865 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -35.7 -56.1 0.69 Allowed 'General case' 0 C--O 1.226 -0.14 0 C-N-CA 125.356 1.462 . . . . 0.0 113.148 -175.643 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -61.69 -41.83 98.11 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.444 0.697 . . . . 0.0 111.18 -176.127 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 53' ' ' ILE . . . . . 0.505 ' H ' ' CD1' ' B' ' 53' ' ' ILE . 1.1 mp -63.75 -54.08 36.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 106.852 -1.536 . . . . 0.0 106.852 -178.289 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 82.5 t -56.84 -41.13 75.22 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-N 115.265 -0.88 . . . . 0.0 109.729 179.157 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.44 -51.81 68.3 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 118.907 0.776 . . . . 0.0 110.073 177.507 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 44.9 mt -53.87 -41.11 67.16 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 119.361 -0.352 . . . . 0.0 111.404 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.05 -61.68 1.68 Allowed 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 118.642 0.656 . . . . 0.0 109.753 175.324 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -44.37 -36.4 2.82 Favored 'General case' 0 C--O 1.225 -0.205 0 C-N-CA 126.644 1.978 . . . . 0.0 111.949 -177.206 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -37.38 -46.88 0.81 Allowed 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 125.661 1.584 . . . . 0.0 112.717 178.48 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -59.27 -49.71 76.8 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 120.665 0.269 . . . . 0.0 110.394 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -64.42 -42.96 95.76 Favored 'General case' 0 C--O 1.225 -0.216 0 C-N-CA 124.089 0.956 . . . . 0.0 110.1 179.27 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.69 -45.33 70.33 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.697 1.599 . . . . 0.0 109.4 176.64 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -73.12 -44.27 60.52 Favored 'General case' 0 C--O 1.227 -0.091 0 C-N-CA 122.94 0.496 . . . . 0.0 112.136 178.563 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 86.0 mttt 58.33 33.2 22.92 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 -166.372 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 54.04 18.8 1.82 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 126.445 1.898 . . . . 0.0 114.53 -169.738 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 54.1 mm-40 -106.35 158.67 16.71 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 106.673 -1.602 . . . . 0.0 106.673 167.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -66.1 142.12 57.89 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.127 172.645 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 14.5 m -86.57 150.78 3.74 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 171.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 5.2 p30 -91.35 172.78 8.29 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 123.293 0.637 . . . . 0.0 111.86 176.327 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -41.42 -62.13 0.92 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.258 1.023 . . . . 0.0 113.591 177.115 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 10.0 tp-100 -65.4 -31.35 72.41 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-N 120.094 1.316 . . . . 0.0 110.808 -177.085 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -64.14 -41.3 97.24 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.175 0.898 . . . . 0.0 110.569 175.692 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -57.78 -49.76 75.52 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 121.462 -0.774 . . . . 0.0 110.023 169.658 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 21.5 mm -60.07 -26.7 36.96 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 O-C-N 121.787 -0.571 . . . . 0.0 110.782 176.445 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 52.8 m -75.05 -37.5 61.67 Favored 'General case' 0 C--O 1.225 -0.225 0 O-C-N 120.95 -1.094 . . . . 0.0 110.345 173.072 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 29.1 t80 -55.29 -55.06 35.79 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 118.914 0.779 . . . . 0.0 109.235 170.667 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 43.9 mt -61.22 -47.3 86.76 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 122.085 -0.385 . . . . 0.0 111.694 177.844 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -62.1 -41.89 99.71 Favored Glycine 0 CA--C 1.526 0.735 0 N-CA-C 110.946 -0.862 . . . . 0.0 110.946 -175.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.18 -46.5 73.74 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 123.498 0.719 . . . . 0.0 110.268 175.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 18.1 tp -49.97 -53.55 25.73 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 174.36 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -53.48 -56.83 13.68 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 124.065 0.946 . . . . 0.0 110.394 175.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 40.3 ttm -47.94 -46.62 32.36 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.79 0.836 . . . . 0.0 111.052 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 30.8 mt -72.89 -51.92 24.85 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 CA-C-O 117.908 -1.044 . . . . 0.0 111.379 -176.149 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.416 0.0 OUTLIER -85.11 -36.46 21.13 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 120.31 1.414 . . . . 0.0 114.711 -175.198 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 32.8 m120 -81.87 62.44 5.66 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 107.259 -1.385 . . . . 0.0 107.259 171.036 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 67.2 mt-10 -44.97 -36.49 3.42 Favored 'General case' 0 C--N 1.339 0.111 0 C-N-CA 126.104 1.762 . . . . 0.0 113.618 -169.548 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -47.77 -31.93 5.41 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.384 1.074 . . . . 0.0 113.015 178.299 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 31.6 mt -50.16 -39.89 45.01 Favored 'General case' 0 C--N 1.34 0.177 0 C-N-CA 122.761 0.424 . . . . 0.0 111.949 174.272 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 8.6 mtmp? -77.83 51.89 0.98 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.7 0.8 . . . . 0.0 111.959 -172.049 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.11 0 CA-C-O 117.57 -1.683 . . . . 0.0 110.34 177.768 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.7 ptm . . . . . 0 N--CA 1.476 0.852 0 CA-C-O 121.966 0.888 . . . . 0.0 110.584 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -72.18 82.72 1.0 Allowed 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.178 -173.796 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.4 m -49.25 158.59 0.72 Allowed Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 124.202 1.001 . . . . 0.0 111.433 170.025 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -47.54 -48.28 15.89 Favored 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 123.354 2.703 . . . . 0.0 113.402 -177.446 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.0 mt -57.42 -49.24 76.87 Favored 'General case' 0 C--O 1.226 -0.183 0 C-N-CA 120.618 -0.433 . . . . 0.0 112.094 173.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -60.97 -41.57 96.63 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 -175.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 19.8 tt0 -59.77 -51.63 68.93 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.801 0.84 . . . . 0.0 110.677 175.214 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.35 -45.67 92.15 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.506 0.669 . . . . 0.0 111.271 -177.46 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 66.1 mt -53.28 -51.75 37.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 169.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.17 -48.2 20.35 Favored Glycine 0 CA--C 1.528 0.86 0 C-N-CA 125.183 1.373 . . . . 0.0 111.835 174.821 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.3 mt -55.12 -55.25 33.18 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 117.83 0.815 . . . . 0.0 110.795 174.067 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.0 mp -58.2 -41.71 84.6 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.55 0.614 . . . . 0.0 111.715 -179.373 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 97.1 mt -60.58 -51.33 74.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 C-N-CA 123.494 0.718 . . . . 0.0 110.733 174.509 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.99 -54.03 36.37 Favored Glycine 0 CA--C 1.521 0.462 0 N-CA-C 109.198 -1.561 . . . . 0.0 109.198 -179.02 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 7.2 mm -51.51 -50.77 28.3 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 C-N-CA 124.102 0.961 . . . . 0.0 110.375 175.145 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -50.63 -60.51 2.96 Favored 'General case' 0 C--N 1.339 0.121 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 177.73 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -59.33 -39.39 82.97 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 121.041 -0.263 . . . . 0.0 111.088 -175.622 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.7 ttpp -53.64 -24.77 15.23 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.096 0.958 . . . . 0.0 111.85 178.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -133.9 42.2 2.95 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 118.461 0.573 . . . . 0.0 110.774 169.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 63.6 p -83.05 -87.62 0.1 Allowed 'General case' 0 N--CA 1.457 -0.114 0 CA-C-O 122.254 1.026 . . . . 0.0 108.487 174.244 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -163.18 71.36 0.2 Allowed Glycine 0 N--CA 1.442 -0.917 0 N-CA-C 106.303 -2.719 . . . . 0.0 106.303 175.481 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 46.7 mtmt -55.82 120.51 7.47 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 178.134 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 58.76 33.32 22.98 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.532 1.133 . . . . 0.0 112.614 -173.446 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -162.0 -103.84 0.18 Allowed Glycine 0 CA--C 1.528 0.875 0 N-CA-C 110.142 -1.183 . . . . 0.0 110.142 173.17 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -79.38 62.79 3.82 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.845 -0.797 . . . . 0.0 111.176 -176.093 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.5 mptm? -39.65 -43.72 1.4 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.254 1.422 . . . . 0.0 114.1 -171.851 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 26.1 m80 -120.15 20.38 12.06 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 -169.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 6.0 p -140.46 173.07 11.86 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 173.281 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.2 pp -160.25 -176.31 5.56 Favored 'General case' 0 C--N 1.337 0.024 0 C-N-CA 123.873 0.869 . . . . 0.0 109.533 176.37 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 87.4 p -152.7 -175.52 5.34 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 119.073 0.851 . . . . 0.0 111.955 -178.811 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -19.7 -69.56 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 129.381 3.072 . . . . 0.0 113.51 175.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -51.53 -50.63 59.64 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 124.874 1.269 . . . . 0.0 110.568 -177.394 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 14.1 mp0 -64.65 -42.77 95.21 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 119.157 -0.449 . . . . 0.0 109.87 -177.485 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 71.9 mt -60.99 -50.1 74.76 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.881 0.764 . . . . 0.0 111.21 177.517 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -59.56 -44.96 93.12 Favored 'General case' 0 CA--C 1.534 0.36 0 O-C-N 121.937 -0.477 . . . . 0.0 110.298 179.117 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 72.0 mt-10 -56.42 -52.36 64.93 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 122.57 0.348 . . . . 0.0 111.197 173.806 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 16.3 mt -49.51 -54.82 15.83 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.726 0.81 . . . . 0.0 109.471 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 40.7 mm -54.45 -65.87 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 175.366 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 -57.0 -49.24 76.39 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -169.398 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.7 -53.76 8.03 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.2 0.6 . . . . 0.0 110.426 -177.291 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -85.22 -16.59 39.73 Favored 'General case' 0 C--N 1.339 0.14 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -168.143 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 94.1 mt -114.34 89.04 2.99 Favored 'General case' 0 N--CA 1.458 -0.073 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 168.619 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 73.3 p -77.77 55.76 1.42 Allowed 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 124.628 1.171 . . . . 0.0 109.366 -178.771 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 63.8 mt -87.21 -56.3 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 N-CA-C 106.732 -1.581 . . . . 0.0 106.732 177.515 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 71.26 -70.85 0.81 Allowed Glycine 0 CA--C 1.527 0.799 0 N-CA-C 110.618 -0.993 . . . . 0.0 110.618 179.061 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 56.1 m -71.24 76.0 0.72 Allowed 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 169.662 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 5.0 mttp -44.48 95.83 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 125.844 1.658 . . . . 0.0 112.385 -176.358 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.5 pp -59.58 -10.56 3.6 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 115.909 1.818 . . . . 0.0 115.909 -169.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -161.19 164.82 30.22 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 119.718 1.145 . . . . 0.0 108.177 169.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 -38.56 -42.82 0.8 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 127.246 2.218 . . . . 0.0 113.578 176.289 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.88 -60.85 0.16 Allowed 'General case' 0 N--CA 1.46 0.038 0 C-N-CA 126.22 1.808 . . . . 0.0 113.3 -177.312 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -67.64 -38.71 84.25 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.836 -171.85 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.592 HD12 ' H ' ' A' ' 53' ' ' ILE . 1.6 mp -61.89 -53.38 48.86 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 N-CA-C 106.164 -1.791 . . . . 0.0 106.164 179.131 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 85.0 t -57.83 -44.46 86.26 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 C-N-CA 124.073 0.949 . . . . 0.0 110.552 -177.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.67 -50.61 73.23 Favored 'General case' 0 CA--C 1.528 0.116 0 CA-C-N 119.262 0.937 . . . . 0.0 111.202 173.263 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 63.2 mt -56.43 -38.22 71.29 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 119.115 -0.469 . . . . 0.0 111.446 178.52 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 23.3 mmt -69.38 -61.76 1.66 Allowed 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.117 0.871 . . . . 0.0 109.683 175.03 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -45.88 -40.47 10.04 Favored 'General case' 0 CA--C 1.52 -0.196 0 C-N-CA 126.96 2.104 . . . . 0.0 111.467 -175.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -38.29 -49.97 1.43 Allowed 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.964 1.305 . . . . 0.0 111.546 174.605 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 77.0 mt -56.69 -50.96 70.59 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 122.495 0.318 . . . . 0.0 110.186 -175.685 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -69.41 -44.9 70.46 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 123.268 0.627 . . . . 0.0 110.911 -179.099 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 16.9 ttm180 -55.65 -47.17 77.11 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 124.128 0.971 . . . . 0.0 110.16 -179.065 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -72.3 -56.29 5.74 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 178.06 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.0 ttmm 52.69 39.01 27.67 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.63 0.729 . . . . 0.0 109.137 -168.826 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 53.5 m-20 66.47 0.02 1.65 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 126.922 2.089 . . . . 0.0 114.617 -174.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 27.5 mm100 -82.93 155.65 23.94 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 119.176 0.898 . . . . 0.0 108.636 168.709 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -73.14 161.16 30.92 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.987 173.805 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.7 m -117.57 160.24 17.24 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 C-N-CA 126.063 1.745 . . . . 0.0 107.955 168.751 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -105.98 -175.02 2.68 Favored 'General case' 0 CA--C 1.528 0.121 0 C-N-CA 125.102 1.361 . . . . 0.0 111.741 178.32 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -47.86 -66.14 0.45 Allowed 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 124.328 1.051 . . . . 0.0 112.001 176.069 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.1 tp60 -60.76 -35.56 76.73 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 119.565 1.075 . . . . 0.0 111.453 -173.251 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -61.61 -47.18 86.61 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.548 -0.72 . . . . 0.0 110.983 175.338 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -54.74 -50.6 67.99 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.993 -0.442 . . . . 0.0 109.954 172.549 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.405 ' CG2' ' CG2' ' B' ' 74' ' ' ILE . 25.3 mm -57.16 -37.45 55.89 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 C-N-CA 122.97 0.508 . . . . 0.0 110.331 177.533 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 86.6 m -68.09 -39.3 82.91 Favored 'General case' 0 N--CA 1.456 -0.143 0 O-C-N 121.513 -0.742 . . . . 0.0 110.315 177.49 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 38.0 t80 -56.57 -54.99 39.51 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 173.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 49.2 mt -59.92 -40.0 87.39 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 120.726 0.298 . . . . 0.0 111.476 176.067 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -60.08 -49.64 76.32 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 -179.093 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.9 -44.96 91.4 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 123.178 0.591 . . . . 0.0 110.25 178.341 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 11.0 tp -50.52 -57.91 7.0 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.636 0.731 . . . . 0.0 109.734 174.654 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.45 -53.58 43.66 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 125.037 1.335 . . . . 0.0 110.303 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 39.4 ttm -52.06 -50.06 62.25 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 125.542 1.537 . . . . 0.0 111.026 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 93.3 mt -69.0 -54.9 17.63 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 CA-C-O 118.698 -0.668 . . . . 0.0 110.294 -174.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.451 0.1 OUTLIER -76.14 -35.46 59.21 Favored 'General case' 0 C--N 1.344 0.351 0 C-N-CA 119.051 -1.06 . . . . 0.0 113.398 -173.599 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.4 m-80 -85.13 63.29 8.02 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 106.593 -1.632 . . . . 0.0 106.593 168.695 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -43.92 -36.77 2.55 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.541 1.136 . . . . 0.0 112.505 -175.729 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.38 -47.46 0.21 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 127.015 2.126 . . . . 0.0 113.165 169.507 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 20.3 mt -45.44 -45.87 13.19 Favored 'General case' 0 C--O 1.225 -0.206 0 C-N-CA 123.974 0.91 . . . . 0.0 111.322 178.58 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 65.5 mttm -64.94 1.11 0.98 Allowed 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 -175.51 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.313 0 CA-C-O 116.227 -2.429 . . . . 0.0 115.245 179.241 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 12.1 tpt . . . . . 0 N--CA 1.474 0.743 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -76.64 76.2 3.31 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 121.412 0.625 . . . . 0.0 109.488 175.064 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -50.41 159.66 0.83 Allowed Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 124.999 1.319 . . . . 0.0 110.841 170.391 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -52.22 -49.35 17.68 Favored 'Trans proline' 0 N--CA 1.459 -0.538 0 C-N-CA 122.599 2.199 . . . . 0.0 112.1 -178.479 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.7 mt -58.09 -45.68 86.76 Favored 'General case' 0 C--O 1.226 -0.182 0 C-N-CA 120.624 -0.431 . . . . 0.0 111.03 174.75 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -58.07 -47.36 83.39 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 118.164 0.438 . . . . 0.0 109.835 -177.345 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 tp60 -60.61 -47.81 84.56 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 122.913 0.485 . . . . 0.0 110.896 177.259 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.66 -45.74 81.8 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.209 0.528 . . . . 0.0 111.46 -176.19 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 74.2 mt -54.14 -51.51 46.31 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 170.241 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.16 -47.46 20.85 Favored Glycine 0 CA--C 1.528 0.869 0 C-N-CA 124.797 1.189 . . . . 0.0 111.889 174.9 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 mt -56.26 -57.31 12.79 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 117.582 0.691 . . . . 0.0 110.635 174.122 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.6 mp -57.9 -41.18 82.08 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.047 0.84 . . . . 0.0 111.805 -177.754 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 74.0 mt -58.22 -56.41 16.27 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 C-N-CA 124.02 0.928 . . . . 0.0 110.741 172.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.64 -50.73 59.17 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 109.942 -1.263 . . . . 0.0 109.942 -176.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.8 mm -51.15 -50.58 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 C-N-CA 124.076 0.95 . . . . 0.0 110.107 173.514 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -54.05 -57.71 10.03 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 118.107 0.412 . . . . 0.0 110.222 179.088 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 41.9 m-70 -63.43 -29.23 70.55 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -176.56 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 64.5 tttp -50.45 -33.21 20.21 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 119.061 0.846 . . . . 0.0 111.841 176.096 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -108.62 -44.37 4.07 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.395 0.678 . . . . 0.0 111.083 177.456 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.2 m -75.26 -32.86 61.2 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.927 0.891 . . . . 0.0 112.751 -174.429 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.25 61.43 3.49 Favored Glycine 0 CA--C 1.523 0.591 0 C-N-CA 124.23 0.919 . . . . 0.0 111.944 -169.438 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 90.1 mttt -136.34 -157.59 0.8 Allowed 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 124.524 1.13 . . . . 0.0 109.361 -176.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -76.58 70.61 3.13 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.858 0.863 . . . . 0.0 111.264 -170.04 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -173.61 -161.75 24.33 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 109.239 -1.544 . . . . 0.0 109.239 176.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -77.81 94.53 4.52 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 177.076 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 36.2 mtmm -59.94 -14.19 14.59 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.032 1.333 . . . . 0.0 113.411 -170.188 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -77.14 -4.75 46.1 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.37 1.068 . . . . 0.0 111.829 174.006 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 20.2 p -137.93 164.69 28.39 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.442 1.097 . . . . 0.0 111.304 -172.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.5 175.67 12.48 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.801 1.24 . . . . 0.0 109.184 169.507 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.2 t -131.39 -163.17 1.29 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.499 1.12 . . . . 0.0 112.55 -176.412 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 6.4 mtpm? -39.71 -67.51 0.22 Allowed 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 128.515 2.726 . . . . 0.0 113.461 -169.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -60.94 -46.85 89.03 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 -169.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -54.35 -44.67 72.35 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.48 0.712 . . . . 0.0 110.747 177.603 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 30.5 mt -65.06 -47.06 78.65 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 118.065 0.393 . . . . 0.0 111.599 178.543 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 58.5 mttp -57.08 -46.48 82.5 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.647 175.338 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -57.66 -49.36 76.74 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 122.955 0.502 . . . . 0.0 110.397 175.684 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 10.4 mt -48.16 -53.47 16.68 Favored 'General case' 0 CA--C 1.527 0.09 0 CA-C-N 119.15 0.886 . . . . 0.0 110.25 178.165 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 39.8 mt -57.84 -62.09 1.08 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.297 175.124 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -50.04 -46.87 53.44 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.484 0.714 . . . . 0.0 112.534 -172.802 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 9.1 mmpt? -81.43 -52.33 7.38 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 125.342 1.457 . . . . 0.0 110.451 -172.198 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -95.75 -16.83 21.68 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 -168.042 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 54.3 mt -120.42 79.3 1.46 Allowed 'General case' 0 C--N 1.335 -0.033 0 C-N-CA 125.309 1.444 . . . . 0.0 108.154 173.712 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 59.4 p -79.11 47.9 0.82 Allowed 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.108 0.963 . . . . 0.0 109.72 -177.361 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 20.5 mt -83.71 79.99 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 -174.842 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -52.95 -47.03 60.37 Favored Glycine 0 CA--C 1.529 0.939 0 N-CA-C 109.967 -1.253 . . . . 0.0 109.967 171.661 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 7.0 m -72.26 65.72 0.62 Allowed 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.398 1.079 . . . . 0.0 110.295 172.768 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 47' ' ' LYS . . . . . 0.655 ' HB3' HD11 ' B' ' 53' ' ' ILE . 62.8 mmtt -48.23 92.41 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.611 1.964 . . . . 0.0 112.293 -173.002 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 77.0 mt -60.47 120.28 9.63 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.358 1.063 . . . . 0.0 113.442 -169.805 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 65.98 -70.88 0.09 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 127.108 2.163 . . . . 0.0 113.708 168.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 18.0 p-10 179.38 -39.72 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 126.584 1.953 . . . . 0.0 109.148 -169.586 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.42 -61.33 0.14 Allowed 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 126.895 2.078 . . . . 0.0 113.831 -177.135 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -67.18 -38.71 85.86 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 120.804 0.335 . . . . 0.0 111.282 -172.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 53' ' ' ILE . . . . . 0.677 HD12 ' H ' ' B' ' 53' ' ' ILE . 2.1 mp -63.18 -53.89 40.31 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 N-CA-C 106.861 -1.533 . . . . 0.0 106.861 179.057 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 79.6 t -55.31 -45.35 77.79 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 C-N-CA 124.309 1.044 . . . . 0.0 110.134 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -58.17 -52.45 65.52 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 118.97 0.805 . . . . 0.0 110.203 176.364 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 62.9 mt -54.79 -39.5 68.51 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 119.43 -0.319 . . . . 0.0 111.418 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.83 -67.35 0.48 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 118.484 0.583 . . . . 0.0 109.524 173.727 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -39.62 -41.2 1.01 Allowed 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 127.364 2.266 . . . . 0.0 112.092 -176.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -37.88 -49.89 1.24 Allowed 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.162 1.385 . . . . 0.0 112.158 176.039 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -65.75 -33.7 76.47 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 111.699 0.259 . . . . 0.0 111.699 -174.261 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -76.8 -53.1 8.37 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 177.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 14.3 ttm180 -48.0 -41.57 25.7 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.311 1.044 . . . . 0.0 110.686 177.276 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -111.93 49.49 0.9 Allowed 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.911 0.884 . . . . 0.0 109.916 -178.298 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -72.36 65.57 0.63 Allowed 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.703 0.683 . . . . 0.0 111.184 176.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 69.17 47.98 0.7 Allowed 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 127.08 2.152 . . . . 0.0 110.284 -169.647 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 6.4 mp0 -128.58 155.93 44.15 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 169.515 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 64.8 mm-40 -105.2 113.87 27.73 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 106.042 -1.836 . . . . 0.0 106.042 169.806 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 12.3 m -79.25 142.28 14.22 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 176.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -82.41 170.31 15.44 Favored 'General case' 0 N--CA 1.461 0.108 0 C-N-CA 122.917 0.487 . . . . 0.0 111.578 177.395 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -35.37 -63.02 0.37 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.051 1.34 . . . . 0.0 112.82 173.177 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 10.1 tp-100 -64.53 -32.37 73.98 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 120.35 1.432 . . . . 0.0 111.817 -175.699 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -66.29 -39.38 89.32 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 120.966 -1.084 . . . . 0.0 110.274 176.06 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.03 -48.59 79.61 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 121.713 -0.617 . . . . 0.0 109.622 169.776 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 0.405 ' CG2' ' CG2' ' A' ' 74' ' ' ILE . 20.0 mm -62.18 -23.89 33.16 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 O-C-N 121.612 -0.68 . . . . 0.0 110.891 175.638 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 39.7 m -77.88 -33.72 51.89 Favored 'General case' 0 C--O 1.224 -0.273 0 O-C-N 120.762 -1.211 . . . . 0.0 110.426 171.765 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -60.16 -55.77 29.72 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.298 -0.876 . . . . 0.0 108.977 170.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 45.4 mt -62.8 -41.62 99.36 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-O 121.035 0.445 . . . . 0.0 111.773 177.186 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.9 -43.27 96.27 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.598 -1.001 . . . . 0.0 110.598 -178.231 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.55 -46.29 86.64 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.349 0.66 . . . . 0.0 110.209 174.795 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 6.8 tp -50.41 -58.14 6.39 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.403 0.621 . . . . 0.0 109.83 174.426 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.5 -52.81 35.1 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.86 1.264 . . . . 0.0 110.21 178.305 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 57.1 ttm -57.14 -47.43 81.17 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 124.19 0.996 . . . . 0.0 111.139 -178.166 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 97.1 mt -65.42 -58.63 6.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 -176.765 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.448 1.1 p90 -67.09 -40.58 86.99 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 118.218 -1.393 . . . . 0.0 112.501 -174.489 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 28.3 m-80 -81.71 66.98 7.51 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 169.409 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -44.0 -35.44 2.07 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.842 1.257 . . . . 0.0 113.815 -171.338 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -32.84 -53.3 0.34 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.537 1.535 . . . . 0.0 112.246 168.787 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 69.1 mt -72.37 0.83 9.07 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.787 1.032 . . . . 0.0 113.787 -171.648 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -68.49 73.31 0.23 Allowed 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 120.108 1.322 . . . . 0.0 109.866 174.68 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.375 0 CA-C-O 117.934 -1.481 . . . . 0.0 110.678 -177.664 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.0 ptm . . . . . 0 N--CA 1.475 0.822 0 N-CA-C 111.08 0.03 . . . . 0.0 111.08 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -130.24 112.55 13.46 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 173.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 40.0 p -73.68 170.58 13.68 Favored Pre-proline 0 N--CA 1.451 -0.38 0 C-N-CA 123.206 0.602 . . . . 0.0 110.059 175.299 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -50.58 -43.93 42.77 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.299 1.999 . . . . 0.0 110.658 168.508 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.448 HD23 ' HA ' ' A' ' 5' ' ' LEU . 4.8 mt -53.38 -61.06 2.54 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-O 119.234 -0.412 . . . . 0.0 111.531 170.204 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -56.9 -39.22 74.01 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 118.495 0.589 . . . . 0.0 111.172 -174.237 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 -61.19 -51.04 70.67 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.782 0.833 . . . . 0.0 110.686 175.504 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.22 -44.9 95.52 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.454 0.702 . . . . 0.0 111.323 -178.682 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 95.4 mt -54.87 -52.26 44.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 171.08 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.3 -47.43 21.71 Favored Glycine 0 CA--C 1.526 0.759 0 C-N-CA 125.309 1.433 . . . . 0.0 111.929 175.003 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 mt -55.14 -54.74 39.38 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 117.739 0.77 . . . . 0.0 110.43 174.022 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.6 mp -58.84 -44.17 90.89 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 119.344 0.975 . . . . 0.0 111.756 -179.325 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 88.5 mt -55.94 -56.53 12.24 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 C-N-CA 123.398 0.679 . . . . 0.0 110.304 174.476 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.19 -50.08 64.15 Favored Glycine 0 CA--C 1.522 0.471 0 N-CA-C 110.046 -1.221 . . . . 0.0 110.046 -176.529 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 8.8 mm -52.94 -47.86 52.54 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 C-N-CA 123.465 0.706 . . . . 0.0 110.139 175.282 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -55.25 -65.15 0.64 Allowed 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 118.432 0.56 . . . . 0.0 109.74 177.456 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 25.5 m-70 -61.92 -26.79 68.39 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 118.41 -0.805 . . . . 0.0 113.018 -172.855 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 65.1 tttp -49.21 -35.99 18.78 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 119.366 0.984 . . . . 0.0 111.107 171.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 71.7 m-85 -103.6 -56.34 2.23 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 122.994 0.518 . . . . 0.0 110.084 177.021 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.5 m -54.9 -34.17 62.8 Favored 'General case' 0 C--O 1.225 -0.231 0 C-N-CA 122.988 0.515 . . . . 0.0 111.924 -176.257 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -48.03 -30.07 7.06 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 124.91 1.243 . . . . 0.0 113.496 176.169 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 32.8 mtmm -65.48 -34.98 79.54 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 118.266 1.033 . . . . 0.0 111.253 177.482 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -74.2 135.23 42.76 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 178.605 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -54.81 -45.17 80.61 Favored Glycine 0 CA--C 1.531 1.038 0 N-CA-C 109.622 -1.391 . . . . 0.0 109.622 172.063 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -78.57 60.5 2.7 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.918 1.287 . . . . 0.0 109.453 172.768 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 3.2 ptmm? -65.57 -0.36 1.98 Allowed 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 115.394 1.627 . . . . 0.0 115.394 -171.773 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 20.8 t-160 -77.32 -17.77 58.03 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.419 1.088 . . . . 0.0 110.378 169.315 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -131.17 156.76 44.77 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 126.542 1.937 . . . . 0.0 110.374 -170.199 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.56 173.5 15.42 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.099 0.96 . . . . 0.0 109.171 173.057 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 54.5 p -117.94 171.97 7.72 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 123.596 0.759 . . . . 0.0 112.28 -172.585 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.7 pttm -31.74 -49.17 0.16 Allowed 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 127.197 2.199 . . . . 0.0 113.416 169.28 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.5 -54.83 42.55 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.411 0.624 . . . . 0.0 109.533 -177.109 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.2 mp0 -60.62 -41.91 95.8 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.339 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 69.6 mt -59.16 -48.77 80.37 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 118.447 0.567 . . . . 0.0 111.405 178.519 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -62.6 -31.57 72.43 Favored 'General case' 0 N--CA 1.457 -0.122 0 C-N-CA 123.397 0.679 . . . . 0.0 110.881 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.43 -68.83 0.34 Allowed 'General case' 0 C--O 1.22 -0.463 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 167.052 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.3 mt -30.13 -65.65 0.11 Allowed 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 126.075 1.75 . . . . 0.0 113.266 -177.452 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 20.0 tt -59.34 -51.94 66.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.231 -175.105 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -57.84 -45.76 85.74 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 125.208 1.403 . . . . 0.0 111.91 -177.889 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.0 mmpt? -72.21 -48.89 39.6 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 124.982 1.313 . . . . 0.0 110.263 -175.226 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -92.58 -52.77 4.48 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.306 0.642 . . . . 0.0 111.052 -169.201 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 31.9 mt -82.67 64.6 7.39 Favored 'General case' 0 C--N 1.335 -0.05 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 172.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 31.7 p -53.54 -67.9 0.22 Allowed 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.062 0.945 . . . . 0.0 109.768 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 53.5 mt 65.9 -60.9 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 127.611 2.364 . . . . 0.0 112.735 172.816 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.19 -69.06 1.98 Allowed Glycine 0 CA--C 1.526 0.723 0 N-CA-C 109.649 -1.38 . . . . 0.0 109.649 -177.192 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 20.0 m -72.12 71.39 0.84 Allowed 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.98 0.912 . . . . 0.0 108.999 173.206 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 31.8 mttt -54.34 96.84 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.157 0.983 . . . . 0.0 111.263 -171.077 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 73.8 mt -37.3 -45.59 0.68 Allowed 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 127.354 2.261 . . . . 0.0 113.804 -171.334 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -154.99 174.48 15.1 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 106.019 -1.845 . . . . 0.0 106.019 176.01 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -51.06 -30.59 16.21 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.914 1.286 . . . . 0.0 112.473 -177.306 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.31 -59.99 0.14 Allowed 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 126.984 2.114 . . . . 0.0 114.421 -176.783 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -63.63 -43.33 97.13 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 121.119 0.485 . . . . 0.0 110.332 -173.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.644 HD12 ' H ' ' A' ' 53' ' ' ILE . 2.5 mp -63.1 -51.2 74.58 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 107.264 -1.384 . . . . 0.0 107.264 -178.75 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 72.7 t -55.11 -49.32 72.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 C-N-CA 123.554 0.742 . . . . 0.0 109.867 178.218 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -53.79 -53.07 57.5 Favored 'General case' 0 CA--C 1.527 0.092 0 CA-C-N 118.826 0.739 . . . . 0.0 110.595 176.338 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.4 mt -51.14 -43.0 61.12 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 119.34 -0.362 . . . . 0.0 111.737 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.48 -68.07 0.48 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 118.411 0.55 . . . . 0.0 109.85 175.38 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -43.86 -35.12 1.83 Allowed 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 128.037 2.535 . . . . 0.0 112.689 -174.34 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -38.39 -48.68 1.38 Allowed 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 124.738 1.215 . . . . 0.0 112.585 171.306 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -65.21 -36.7 84.99 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 117.877 0.308 . . . . 0.0 111.349 -176.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -71.04 -43.99 66.71 Favored 'General case' 0 C--O 1.226 -0.135 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 179.282 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 22.5 ttm105 -56.75 -52.9 63.2 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.195 0.598 . . . . 0.0 110.18 175.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 -81.04 60.99 4.44 Favored 'General case' 0 C--O 1.233 0.214 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -177.13 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 17.5 ttmm -74.65 69.88 1.79 Allowed 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.107 0.963 . . . . 0.0 109.763 -176.467 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 52.6 43.89 30.69 Favored 'General case' 0 CA--C 1.528 0.101 0 C-N-CA 124.908 1.283 . . . . 0.0 109.898 -169.439 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -141.44 149.62 41.23 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 125.788 1.635 . . . . 0.0 107.036 175.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -86.14 172.57 10.46 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.292 1.037 . . . . 0.0 109.269 169.387 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.6 m -119.13 149.21 21.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 169.083 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.8 p30 -93.2 169.15 10.61 Favored 'General case' 0 C--O 1.232 0.169 0 C-N-CA 123.677 0.791 . . . . 0.0 110.096 172.115 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -34.63 -59.0 0.48 Allowed 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 124.95 1.3 . . . . 0.0 113.261 176.041 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 34.6 tp60 -68.2 -29.25 68.05 Favored 'General case' 0 CA--C 1.528 0.116 0 O-C-N 120.848 -1.158 . . . . 0.0 111.464 -173.078 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.2 -31.7 66.12 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.408 -0.808 . . . . 0.0 110.063 174.085 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -61.16 -47.26 87.02 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.365 -0.834 . . . . 0.0 109.254 167.563 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 26.5 mm -59.96 -29.48 43.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 O-C-N 121.784 -0.572 . . . . 0.0 110.586 174.759 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 28.6 m -72.38 -39.15 68.25 Favored 'General case' 0 C--O 1.225 -0.195 0 O-C-N 121.26 -0.9 . . . . 0.0 111.225 172.269 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 48.1 t80 -58.83 -54.71 43.98 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 118.88 0.764 . . . . 0.0 109.454 174.414 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 29.2 mt -59.46 -44.97 92.88 Favored 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 122.477 0.311 . . . . 0.0 111.068 175.174 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -60.4 -39.86 96.79 Favored Glycine 0 CA--C 1.524 0.651 0 C-N-CA 123.727 0.679 . . . . 0.0 111.464 -178.122 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.99 -49.64 56.05 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.819 0.848 . . . . 0.0 110.057 176.61 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -47.38 -53.8 12.9 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.607 0.763 . . . . 0.0 109.731 173.632 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -54.62 -60.65 3.07 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 124.669 1.187 . . . . 0.0 110.6 176.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 53.9 ttm -48.93 -45.28 41.4 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 124.037 0.935 . . . . 0.0 111.333 -178.568 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 57.4 mt -65.82 -60.09 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-O 118.482 -0.77 . . . . 0.0 109.901 -178.05 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.379 0.0 OUTLIER -76.64 -31.61 57.48 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 113.96 1.096 . . . . 0.0 113.96 -172.67 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.7 m120 -82.39 58.02 3.92 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 169.801 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -39.53 -40.44 0.86 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 127.251 2.22 . . . . 0.0 115.046 -168.285 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -45.9 -38.41 7.45 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.914 1.286 . . . . 0.0 112.375 178.581 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 93.0 mt -55.89 -28.85 58.6 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -75.71 64.7 1.77 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.751 0.705 . . . . 0.0 109.609 174.451 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.148 0 CA-C-O 117.351 -1.805 . . . . 0.0 110.912 -177.02 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 24.9 ptm . . . . . 0 N--CA 1.475 0.822 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -81.34 67.34 7.24 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 122.894 0.478 . . . . 0.0 110.136 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.5 m -47.58 156.68 0.63 Allowed Pre-proline 0 CA--C 1.534 0.343 0 C-N-CA 126.245 1.818 . . . . 0.0 112.323 -179.38 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -41.65 -49.75 5.15 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 123.947 3.098 . . . . 0.0 114.25 -177.821 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 4.5 mt -56.19 -51.08 69.34 Favored 'General case' 0 N--CA 1.457 -0.111 0 N-CA-C 113.175 0.806 . . . . 0.0 113.175 172.517 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -61.68 -36.68 81.58 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 118.353 0.524 . . . . 0.0 109.85 -178.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -59.97 -53.8 53.57 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 124.396 1.078 . . . . 0.0 109.551 175.617 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.05 -47.41 86.53 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.102 0.961 . . . . 0.0 111.148 -178.214 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 72.0 mt -52.84 -53.0 23.37 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 170.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -49.29 -44.57 35.08 Favored Glycine 0 CA--C 1.525 0.676 0 C-N-CA 125.45 1.5 . . . . 0.0 111.882 176.864 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.1 mt -59.32 -54.45 46.67 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.651 0.78 . . . . 0.0 110.89 174.54 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 mp -58.49 -43.36 88.97 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 118.911 0.778 . . . . 0.0 111.43 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 85.4 mt -57.73 -52.65 55.04 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.207 0 C-N-CA 123.739 0.816 . . . . 0.0 110.611 173.012 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.25 -50.18 60.63 Favored Glycine 0 CA--C 1.523 0.551 0 N-CA-C 109.788 -1.325 . . . . 0.0 109.788 -177.313 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.9 mm -54.2 -50.81 53.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 C-N-CA 123.391 0.676 . . . . 0.0 110.387 175.216 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 16' ' ' PHE . . . . . 0.413 ' HB2' ' CE2' ' B' ' 73' ' ' TYR . 39.7 t80 -53.43 -56.59 15.58 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 121.699 0.762 . . . . 0.0 110.862 177.75 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 44.1 t60 -63.85 -37.4 87.25 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 124.573 1.149 . . . . 0.0 110.696 -171.587 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -49.67 -49.3 47.98 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.913 0.885 . . . . 0.0 110.91 175.006 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -88.42 -33.39 17.9 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 122.277 -0.264 . . . . 0.0 111.121 -174.846 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 14.6 m -63.46 -41.71 98.62 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 118.346 0.521 . . . . 0.0 110.721 175.564 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -23.05 -60.53 0.03 OUTLIER Glycine 0 C--N 1.339 0.697 0 C-N-CA 128.433 2.921 . . . . 0.0 114.397 -179.284 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 58.7 pttt -58.46 -41.5 85.3 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -172.375 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -87.1 36.15 0.72 Allowed 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.542 0.942 . . . . 0.0 113.542 -168.596 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 71.68 -68.52 0.99 Allowed Glycine 0 CA--C 1.53 0.995 0 C-N-CA 123.681 0.658 . . . . 0.0 112.625 171.718 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -78.34 71.54 4.81 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 178.118 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 56.9 pttt -71.26 27.33 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.612 1.565 . . . . 0.0 114.494 -171.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 18.0 m80 -128.94 11.15 6.03 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.964 1.705 . . . . 0.0 109.529 170.271 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 59.3 p -139.57 158.61 43.83 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.725 1.61 . . . . 0.0 107.624 172.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -161.4 179.01 8.61 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.057 171.457 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.3 t -135.68 -165.74 1.74 Allowed 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.659 1.118 . . . . 0.0 112.441 -176.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 24.1 pttm -47.14 -52.05 16.52 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 126.575 1.95 . . . . 0.0 112.618 -170.468 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 18.8 tptp -52.1 -51.31 58.55 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 124.247 1.019 . . . . 0.0 110.825 178.79 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 27.9 mp0 -69.21 -36.5 77.31 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.282 -176.425 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 19.2 mt -66.03 -47.67 73.62 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 118.842 0.746 . . . . 0.0 111.429 176.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -57.69 -48.72 78.76 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 175.241 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 58.2 mt-10 -53.04 -58.34 7.32 Favored 'General case' 0 C--O 1.222 -0.384 0 CA-C-O 119.363 -0.351 . . . . 0.0 110.914 172.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 10.2 mt -44.46 -62.56 1.14 Allowed 'General case' 0 CA--C 1.521 -0.165 0 C-N-CA 124.521 1.128 . . . . 0.0 110.229 179.75 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 15.3 tt -63.35 -47.01 93.96 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 C-N-CA 120.064 -0.654 . . . . 0.0 110.449 -174.9 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 16.0 tt0 -60.13 -49.34 78.02 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.409 -0.807 . . . . 0.0 111.717 -177.411 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -73.85 -52.15 13.94 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.838 0.855 . . . . 0.0 109.766 -175.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -85.15 -18.75 33.19 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -169.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 15.6 mt -133.47 60.54 1.7 Allowed 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 124.605 1.162 . . . . 0.0 108.364 175.214 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 7.0 p -52.51 -66.24 0.42 Allowed 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 123.773 0.829 . . . . 0.0 109.66 174.164 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 62.8 mt 69.03 -51.1 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 127.126 2.17 . . . . 0.0 112.312 175.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.13 -68.0 3.18 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 109.057 -1.617 . . . . 0.0 109.057 -178.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 42.5 p -75.12 69.06 1.97 Allowed 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 170.524 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 47' ' ' LYS . . . . . 0.411 ' CB ' HD11 ' B' ' 53' ' ' ILE . 52.8 mttm -55.92 95.38 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.331 1.052 . . . . 0.0 110.875 -172.071 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 86.8 mt -46.65 118.07 1.88 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.667 1.587 . . . . 0.0 113.598 -169.17 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 69.43 -67.98 0.21 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 126.767 2.027 . . . . 0.0 113.165 168.673 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 179.78 -37.32 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 125.967 1.707 . . . . 0.0 110.556 -171.734 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -37.69 -56.47 1.06 Allowed 'General case' 0 C--O 1.225 -0.209 0 C-N-CA 125.383 1.473 . . . . 0.0 113.874 -171.002 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -61.21 -40.36 93.67 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.275 0.56 . . . . 0.0 110.88 -175.257 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 53' ' ' ILE . . . . . 0.672 HD12 ' H ' ' B' ' 53' ' ' ILE . 2.4 mp -68.44 -49.85 62.1 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 N-CA-C 106.873 -1.528 . . . . 0.0 106.873 -177.144 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 92.9 t -53.83 -45.06 62.12 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.263 0 C-N-CA 123.239 0.616 . . . . 0.0 110.141 175.655 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -57.17 -52.74 64.09 Favored 'General case' 0 CA--C 1.527 0.075 0 CA-C-N 118.715 0.689 . . . . 0.0 110.235 175.512 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 30.9 mt -52.51 -41.36 63.37 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 119.038 -0.505 . . . . 0.0 111.419 178.375 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 27.6 mmt -68.94 -61.9 1.61 Allowed 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.926 0.785 . . . . 0.0 109.914 176.329 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -44.11 -36.38 2.57 Favored 'General case' 0 CA--C 1.522 -0.131 0 C-N-CA 127.724 2.41 . . . . 0.0 111.899 -177.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -38.86 -49.42 1.65 Allowed 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 124.542 1.137 . . . . 0.0 112.061 175.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -57.87 -53.77 54.49 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.342 0.519 . . . . 0.0 109.909 -178.381 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -60.95 -39.63 90.25 Favored 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 124.352 1.061 . . . . 0.0 111.011 -178.57 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 36.0 ttm-85 -62.36 -54.94 33.06 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.473 0.709 . . . . 0.0 109.902 178.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 -69.8 -46.34 65.91 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-O 119.642 -0.218 . . . . 0.0 111.138 -173.4 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 47.8 mttp 52.23 36.13 18.61 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.272 0.558 . . . . 0.0 110.142 -169.029 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 37.4 m-20 57.47 24.82 10.69 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 125.705 1.602 . . . . 0.0 113.565 -174.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 69.4 mm-40 -101.97 159.92 14.94 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 123.632 0.773 . . . . 0.0 109.275 170.01 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 10.7 mp0 -77.63 115.98 17.82 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 124.615 1.166 . . . . 0.0 108.625 169.699 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 33.7 m -79.58 155.17 4.67 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 172.464 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 3.5 p30 -101.07 171.96 7.31 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.638 0.733 . . . . 0.0 110.527 171.359 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -31.8 -58.35 0.28 Allowed 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 126.627 1.971 . . . . 0.0 113.65 178.061 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 44.3 tp60 -65.9 -39.14 90.34 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.943 1.247 . . . . 0.0 112.201 -169.253 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -69.37 -38.78 78.22 Favored 'General case' 0 C--O 1.234 0.248 0 O-C-N 121.57 -0.706 . . . . 0.0 109.732 177.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 73' ' ' TYR . . . . . 0.413 ' CE2' ' HB2' ' B' ' 16' ' ' PHE . 1.0 OUTLIER -54.96 -55.47 30.37 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 171.77 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 19.3 mm -50.59 -48.34 26.89 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.26 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 178.336 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 34.2 m -59.88 -20.87 59.7 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -179.424 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 15.3 t80 -61.25 -49.31 77.62 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 119.48 1.036 . . . . 0.0 108.398 169.312 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 44.2 mt -71.3 -39.48 71.43 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.164 0.986 . . . . 0.0 110.936 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -58.31 -50.03 70.47 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.025 -1.23 . . . . 0.0 110.025 176.041 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.2 -45.68 93.58 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 122.817 0.447 . . . . 0.0 110.638 175.406 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 14.8 tp -51.46 -56.07 15.35 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.087 0.47 . . . . 0.0 110.075 177.57 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.42 -58.78 5.31 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 124.323 1.049 . . . . 0.0 109.896 175.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 55.6 ttm -50.63 -44.97 57.51 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.93 0.892 . . . . 0.0 111.315 -176.833 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 98.6 mt -70.19 -62.3 1.34 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 118.322 -0.846 . . . . 0.0 110.822 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.427 0.1 OUTLIER -71.38 -38.97 71.47 Favored 'General case' 0 C--N 1.347 0.476 0 C-N-CA 118.691 -1.204 . . . . 0.0 112.676 -170.919 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -85.98 62.54 7.51 Favored 'General case' 0 C--N 1.335 -0.048 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 168.43 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -42.72 -36.84 1.56 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.709 1.604 . . . . 0.0 112.573 -176.233 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -31.87 -49.68 0.18 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 126.804 2.042 . . . . 0.0 112.7 169.506 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 17.3 mt -47.36 -40.77 18.19 Favored 'General case' 0 C--O 1.226 -0.183 0 C-N-CA 124.561 1.144 . . . . 0.0 112.608 -179.592 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -59.87 -24.59 64.38 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.222 0.465 . . . . 0.0 111.898 -177.235 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.16 0 CA-C-O 117.595 -1.67 . . . . 0.0 111.072 176.249 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 82.3 mtp . . . . . 0 N--CA 1.476 0.853 0 CA-C-O 120.892 0.377 . . . . 0.0 110.595 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.96 78.02 0.05 OUTLIER 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.702 1.201 . . . . 0.0 110.202 178.274 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 14.9 m -64.5 164.5 19.38 Favored Pre-proline 0 CA--C 1.539 0.557 0 C-N-CA 125.137 1.375 . . . . 0.0 110.013 -176.758 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_exo -47.61 -47.95 16.87 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 123.171 2.58 . . . . 0.0 113.042 -178.837 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.419 HD23 ' HA ' ' A' ' 5' ' ' LEU . 5.2 mt -56.4 -47.49 78.89 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-O 119.195 -0.431 . . . . 0.0 112.036 173.201 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -61.66 -41.34 97.41 Favored 'General case' 0 C--O 1.227 -0.11 0 CA-C-N 118.717 0.689 . . . . 0.0 109.649 -176.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.5 tt0 -62.03 -49.78 74.64 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 122.855 0.462 . . . . 0.0 110.826 175.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.8 -46.34 89.97 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.534 0.683 . . . . 0.0 111.423 -178.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 68.8 mt -53.7 -52.31 35.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.196 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 170.385 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.87 -47.35 19.25 Favored Glycine 0 CA--C 1.526 0.769 0 C-N-CA 125.204 1.383 . . . . 0.0 111.88 175.478 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 mt -55.69 -54.86 39.13 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 117.706 0.753 . . . . 0.0 110.958 173.819 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.11 -44.35 87.65 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 118.809 0.731 . . . . 0.0 111.742 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.425 HD11 ' HB1' ' B' ' 81' ' ' ALA . 83.1 mt -56.81 -53.8 37.59 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 C-N-CA 123.422 0.689 . . . . 0.0 110.003 174.467 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -53.88 -50.22 55.45 Favored Glycine 0 CA--C 1.523 0.538 0 N-CA-C 110.111 -1.196 . . . . 0.0 110.111 -178.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 7.3 mm -55.33 -46.48 78.29 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 123.269 0.628 . . . . 0.0 110.513 176.028 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -56.23 -57.88 10.31 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 118.738 0.699 . . . . 0.0 110.233 175.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -56.41 -37.14 69.76 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 124.158 0.983 . . . . 0.0 111.234 -175.352 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -51.04 -32.16 20.77 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.801 1.24 . . . . 0.0 111.903 178.271 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -108.61 -53.44 2.64 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.108 0.563 . . . . 0.0 110.233 177.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 23.1 t -53.04 -37.89 61.96 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.458 0.703 . . . . 0.0 110.921 -179.267 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -50.72 -24.93 8.46 Favored Glycine 0 CA--C 1.53 1.003 0 C-N-CA 124.157 0.884 . . . . 0.0 114.076 176.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 54.5 mttp -91.85 -12.12 34.54 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 118.227 1.013 . . . . 0.0 112.355 -178.583 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -73.89 164.91 26.02 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.423 0.556 . . . . 0.0 109.504 176.272 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -64.49 -62.14 5.35 Favored Glycine 0 CA--C 1.53 0.973 0 N-CA-C 109.475 -1.45 . . . . 0.0 109.475 172.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -80.99 93.79 6.42 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 170.519 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 49.9 mtmt -74.33 34.91 0.09 Allowed 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 123.907 0.883 . . . . 0.0 112.912 -176.308 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 10.6 m80 -125.07 -7.9 7.15 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 127.019 2.128 . . . . 0.0 109.85 176.757 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 41.6 p -133.68 170.56 15.38 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 125.057 1.343 . . . . 0.0 108.516 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -161.36 170.8 19.42 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.548 1.139 . . . . 0.0 108.212 169.144 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 59.9 p -127.22 173.97 9.31 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 119.343 0.974 . . . . 0.0 112.482 -169.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.4 ptmm? -26.48 -55.9 0.08 Allowed 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 128.339 2.656 . . . . 0.0 114.565 175.074 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -55.63 -55.65 29.58 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 123.457 0.703 . . . . 0.0 110.233 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 7.7 mp0 -62.59 -35.64 80.16 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-O 118.949 -0.548 . . . . 0.0 110.49 -179.212 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 51.7 mt -66.69 -50.22 63.58 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 118.755 0.707 . . . . 0.0 111.217 178.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -59.77 -43.73 94.22 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 110.094 -0.335 . . . . 0.0 110.094 177.159 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -55.9 -64.83 0.73 Allowed 'General case' 0 C--O 1.219 -0.508 0 CA-C-O 118.467 -0.778 . . . . 0.0 109.646 170.834 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.3 mt -35.56 -62.16 0.42 Allowed 'General case' 0 N--CA 1.461 0.112 0 C-N-CA 125.42 1.488 . . . . 0.0 111.499 179.26 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 9.2 tt -60.81 -51.58 71.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 120.292 -0.563 . . . . 0.0 109.866 -174.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -60.61 -42.4 96.76 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.588 -0.695 . . . . 0.0 112.443 -177.106 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -72.67 -55.04 7.42 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.93 1.292 . . . . 0.0 109.534 -175.212 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -85.97 -24.97 26.3 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.735 0.814 . . . . 0.0 113.005 -168.081 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 67.9 mt -105.58 91.45 3.77 Favored 'General case' 0 C--N 1.338 0.099 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 168.441 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 60.9 p -78.14 50.7 0.92 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.175 0.99 . . . . 0.0 109.479 -179.684 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 69.4 mt -92.38 81.84 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 -173.381 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -55.63 -49.33 65.96 Favored Glycine 0 CA--C 1.529 0.922 0 N-CA-C 109.701 -1.359 . . . . 0.0 109.701 173.776 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 7.2 m -71.82 69.54 0.69 Allowed 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.213 1.005 . . . . 0.0 110.07 172.104 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 30.8 mmtp -45.73 95.44 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 126.151 1.781 . . . . 0.0 111.289 -178.306 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 93.8 mt -58.73 120.23 8.57 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.471 1.109 . . . . 0.0 113.515 -169.265 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 56.66 -96.56 0.06 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.873 1.669 . . . . 0.0 112.303 166.557 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -142.12 -40.3 0.36 Allowed 'General case' 0 N--CA 1.462 0.125 0 C-N-CA 124.076 0.951 . . . . 0.0 111.283 179.22 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -34.16 -57.98 0.47 Allowed 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 125.181 1.392 . . . . 0.0 113.81 -173.396 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 77.1 tt0 -66.04 -40.94 91.42 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.975 0.51 . . . . 0.0 111.486 -174.092 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.603 HD12 ' H ' ' A' ' 53' ' ' ILE . 2.2 mp -63.05 -52.69 56.0 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.46 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 -179.775 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 77.6 t -54.36 -48.27 68.42 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 C-N-CA 123.975 0.91 . . . . 0.0 109.877 177.86 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -53.56 -52.94 58.1 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 118.871 0.759 . . . . 0.0 111.112 177.091 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 30.9 mt -52.59 -42.88 64.92 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 119.378 -0.344 . . . . 0.0 111.462 -179.619 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.52 -63.54 1.1 Allowed 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 118.457 0.571 . . . . 0.0 109.873 176.687 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -38.93 -46.35 1.3 Allowed 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 127.327 2.251 . . . . 0.0 111.818 -177.74 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -38.91 -48.81 1.62 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.701 1.2 . . . . 0.0 112.6 177.064 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.1 mp -57.39 -51.56 68.91 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 -177.186 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -65.94 -40.99 91.87 Favored 'General case' 0 C--O 1.225 -0.231 0 C-N-CA 122.654 0.382 . . . . 0.0 110.764 179.653 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 12.7 ttp180 -60.07 -41.76 93.08 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 122.842 0.457 . . . . 0.0 110.568 -178.072 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -87.37 -59.77 2.16 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-O 120.858 0.361 . . . . 0.0 111.333 -177.208 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 54.4 mttp 63.31 -73.04 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 126.005 1.722 . . . . 0.0 108.708 -166.141 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -138.05 -17.66 1.21 Allowed 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.94 1.696 . . . . 0.0 111.765 172.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 59.9 tp60 -71.37 129.7 39.48 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 118.703 0.683 . . . . 0.0 109.809 -174.747 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 21.1 mp0 -73.99 131.91 41.87 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 171.532 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.7 m -83.19 150.71 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 176.236 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -89.64 177.07 6.63 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 123.267 0.627 . . . . 0.0 110.693 175.058 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -44.43 -60.86 1.75 Allowed 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.84 0.856 . . . . 0.0 111.861 174.19 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.0 tp60 -62.49 -35.81 80.53 Favored 'General case' 0 C--O 1.225 -0.19 0 CA-C-N 119.376 0.989 . . . . 0.0 111.822 -173.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -65.51 -40.53 93.12 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 119.519 1.054 . . . . 0.0 111.277 174.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -55.62 -51.77 66.07 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.801 -0.562 . . . . 0.0 109.525 170.345 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 29.0 mm -56.53 -39.91 65.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 O-C-N 122.029 -0.419 . . . . 0.0 110.335 177.216 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 84.8 m -64.19 -39.59 94.31 Favored 'General case' 0 C--O 1.226 -0.151 0 O-C-N 121.614 -0.679 . . . . 0.0 110.384 178.715 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -55.27 -53.33 57.45 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 173.418 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 61.7 mt -60.32 -42.35 95.42 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.673 -0.24 . . . . 0.0 111.572 177.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -62.31 -46.9 92.93 Favored Glycine 0 CA--C 1.526 0.768 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 -179.083 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.6 -48.83 77.72 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 122.173 -0.604 . . . . 0.0 109.758 177.248 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 16.7 tp -50.37 -57.96 6.78 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.72 0.772 . . . . 0.0 110.029 176.052 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.447 ' HB1' HD11 ' B' ' 13' ' ' ILE . . . -48.42 -54.88 12.46 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 125.109 1.364 . . . . 0.0 109.955 177.772 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 9.1 ttp -59.99 -48.31 82.24 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 123.342 0.657 . . . . 0.0 111.655 -176.802 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.404 HD13 HG21 ' A' ' 83' ' ' ILE . 93.7 mt -59.55 -54.28 36.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 CA-C-O 118.135 -0.936 . . . . 0.0 110.128 -179.033 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.439 1.3 p90 -76.41 -38.72 55.18 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 120.097 1.317 . . . . 0.0 113.309 -175.742 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 27.8 m-80 -79.88 74.19 6.62 Favored 'General case' 0 N--CA 1.463 0.206 0 O-C-N 121.008 -1.058 . . . . 0.0 108.552 173.169 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -36.33 -43.19 0.36 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.309 1.444 . . . . 0.0 113.512 176.695 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -39.97 -41.96 1.29 Allowed 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.11 1.764 . . . . 0.0 113.54 174.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 47.6 mt -62.71 -28.41 69.93 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-O 118.864 -0.589 . . . . 0.0 112.349 -178.505 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.62 58.5 1.8 Allowed 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.553 1.07 . . . . 0.0 109.178 170.194 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.313 0 CA-C-O 116.38 -2.344 . . . . 0.0 110.256 179.547 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.915 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -71.26 78.06 0.72 Allowed 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.408 0.683 . . . . 0.0 111.005 -177.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.1 m -54.89 163.23 1.53 Allowed Pre-proline 0 CA--C 1.54 0.587 0 C-N-CA 124.686 1.194 . . . . 0.0 111.698 175.65 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -46.89 -50.33 10.99 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 123.597 2.864 . . . . 0.0 113.185 179.685 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.2 mt -54.73 -48.6 72.34 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-O 119.476 -0.297 . . . . 0.0 111.535 173.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -61.4 -42.38 98.63 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 118.315 0.507 . . . . 0.0 109.973 -176.036 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.2 tp60 -63.64 -47.22 82.23 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 122.367 0.267 . . . . 0.0 110.922 176.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.5 -47.19 82.75 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 121.339 0.59 . . . . 0.0 110.869 -178.012 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 69.5 mt -52.68 -55.34 11.76 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.248 0 N-CA-C 108.075 -1.084 . . . . 0.0 108.075 169.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -45.77 -45.97 13.41 Favored Glycine 0 CA--C 1.526 0.772 0 C-N-CA 125.352 1.453 . . . . 0.0 112.079 177.033 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.2 mt -55.72 -55.92 26.6 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.493 0.717 . . . . 0.0 110.782 173.371 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.9 mp -58.51 -43.03 88.97 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 118.898 0.772 . . . . 0.0 111.863 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 13' ' ' ILE . . . . . 0.447 HD11 ' HB1' ' A' ' 81' ' ' ALA . 52.1 mt -57.48 -57.76 8.88 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 C-N-CA 123.435 0.694 . . . . 0.0 109.938 174.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.06 -48.84 61.53 Favored Glycine 0 CA--C 1.521 0.421 0 N-CA-C 109.968 -1.253 . . . . 0.0 109.968 -177.164 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 5.8 mm -54.22 -46.88 68.32 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 C-N-CA 123.515 0.726 . . . . 0.0 110.878 175.274 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -56.62 -61.42 2.44 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 118.719 0.69 . . . . 0.0 109.32 175.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -55.02 -37.33 66.51 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.727 0.811 . . . . 0.0 111.771 -173.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -45.68 -38.95 7.35 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.289 1.435 . . . . 0.0 111.197 175.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -101.56 -60.15 1.58 Allowed 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 176.013 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.5 m -50.63 -34.26 25.51 Favored 'General case' 0 C--N 1.338 0.091 0 C-N-CA 123.845 0.858 . . . . 0.0 112.617 -173.061 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -36.53 -48.35 1.24 Allowed Glycine 0 CA--C 1.527 0.786 0 C-N-CA 124.616 1.103 . . . . 0.0 112.745 173.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 10.6 ptpt -76.71 -13.94 59.99 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 113.191 0.812 . . . . 0.0 113.191 -171.32 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -74.53 -7.32 52.71 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.405 0.548 . . . . 0.0 112.046 -175.097 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 77.92 -60.77 3.78 Favored Glycine 0 CA--C 1.527 0.799 0 N-CA-C 109.421 -1.471 . . . . 0.0 109.421 -176.409 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -78.18 70.29 4.52 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 169.323 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 7.1 mttp -63.22 -7.84 6.91 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.433 1.093 . . . . 0.0 113.92 -169.61 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 11.9 t-80 -76.0 -15.42 60.15 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.877 0.871 . . . . 0.0 110.994 173.008 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 1.1 p -129.65 160.99 31.62 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 125.374 1.469 . . . . 0.0 110.715 -173.45 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -156.51 161.37 40.02 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.081 0.552 . . . . 0.0 111.449 169.496 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 75.5 m -108.2 158.76 17.16 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.649 1.18 . . . . 0.0 113.145 -174.84 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 14.5 ptpt -22.64 -58.35 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 129.048 2.939 . . . . 0.0 115.397 179.456 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 18.2 tppt? -46.52 -50.04 17.72 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.24 1.016 . . . . 0.0 111.094 179.222 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 80.1 mt-10 -69.67 -27.94 65.45 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 119.037 -0.506 . . . . 0.0 111.847 -178.273 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 19.7 mt -73.9 -46.37 44.92 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 119.153 0.888 . . . . 0.0 110.049 176.756 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 39.0 mttp -56.16 -47.87 77.41 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 172.554 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -55.04 -56.62 17.77 Favored 'General case' 0 C--O 1.223 -0.336 0 CA-C-O 119.044 -0.503 . . . . 0.0 111.037 172.144 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 11.1 mt -45.95 -59.56 2.76 Favored 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 123.38 0.672 . . . . 0.0 110.299 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 15.5 tt -62.91 -50.76 78.36 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 C-N-CA 119.8 -0.76 . . . . 0.0 110.197 -177.008 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -59.35 -51.1 71.39 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.078 -1.014 . . . . 0.0 112.302 -175.648 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.1 -52.82 12.82 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.736 0.815 . . . . 0.0 110.208 -177.091 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -88.99 -18.15 27.97 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 -167.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 42.6 mt -123.37 68.46 1.01 Allowed 'General case' 0 CA--C 1.526 0.054 0 C-N-CA 125.255 1.422 . . . . 0.0 107.874 172.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 74.8 p -55.68 -57.08 13.49 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.677 -176.33 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 80.2 mt 67.65 -61.51 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 C-N-CA 126.89 2.076 . . . . 0.0 111.982 172.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.14 -66.27 2.23 Favored Glycine 0 CA--C 1.527 0.812 0 N-CA-C 110.154 -1.178 . . . . 0.0 110.154 -177.286 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 36.0 p -70.47 78.93 0.56 Allowed 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.745 0.818 . . . . 0.0 109.032 173.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 31.3 mmtm -39.09 95.47 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 126.455 1.902 . . . . 0.0 111.597 178.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 95.6 mt -65.83 84.56 0.08 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.742 1.217 . . . . 0.0 112.308 -169.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 71.62 -66.86 0.28 Allowed 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 126.937 2.095 . . . . 0.0 113.001 167.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 18.1 p-10 -164.83 -46.66 0.03 OUTLIER 'General case' 0 C--O 1.225 -0.231 0 C-N-CA 123.705 0.802 . . . . 0.0 111.054 -169.45 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -42.52 -54.45 3.9 Favored 'General case' 0 C--O 1.225 -0.188 0 C-N-CA 123.912 0.885 . . . . 0.0 113.182 -169.906 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -59.42 -43.46 93.05 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.675 0.79 . . . . 0.0 110.848 -178.058 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 53' ' ' ILE . . . . . 0.56 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.2 mp -63.22 -52.53 57.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 N-CA-C 106.927 -1.508 . . . . 0.0 106.927 -178.389 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 84.7 t -56.72 -43.93 80.43 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 C-N-CA 124.248 1.019 . . . . 0.0 110.295 179.441 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -57.29 -53.7 55.17 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 119.023 0.829 . . . . 0.0 110.03 175.13 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 30.8 mt -51.88 -44.16 63.62 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 119.184 -0.436 . . . . 0.0 111.088 178.684 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 27.2 mmt -65.97 -65.31 0.69 Allowed 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 109.524 -0.546 . . . . 0.0 109.524 176.116 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -40.72 -43.09 1.89 Allowed 'General case' 0 CA--C 1.52 -0.196 0 C-N-CA 127.826 2.45 . . . . 0.0 111.89 -175.155 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -38.7 -48.76 1.52 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.21 1.004 . . . . 0.0 112.312 176.774 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.4 pp -61.85 -37.84 85.99 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 117.915 0.325 . . . . 0.0 111.479 -175.862 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -76.18 -47.15 25.19 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 179.266 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 14.1 ttm180 -50.57 -41.46 54.34 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.244 0.617 . . . . 0.0 110.283 177.073 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -82.94 19.79 1.31 Allowed 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 39.2 mtmt -58.36 -33.07 69.15 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 120.156 1.344 . . . . 0.0 108.471 166.476 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -74.74 12.4 0.83 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.334 1.054 . . . . 0.0 112.788 172.544 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 72.62 -45.36 0.62 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 126.998 2.119 . . . . 0.0 113.214 177.201 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -139.79 162.43 35.17 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.655 1.182 . . . . 0.0 109.572 178.673 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 5.3 m -118.77 149.86 21.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 C-N-CA 124.991 1.316 . . . . 0.0 107.619 172.6 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -86.84 174.62 8.66 Favored 'General case' 0 CA--C 1.527 0.093 0 C-N-CA 124.272 1.029 . . . . 0.0 111.79 176.219 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 49.3 t80 -46.31 -61.91 1.58 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.717 0.807 . . . . 0.0 113.156 178.015 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 10.1 tp-100 -63.8 -32.49 74.02 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 120.183 1.356 . . . . 0.0 111.071 -177.354 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -62.61 -41.7 99.14 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 119.533 1.061 . . . . 0.0 110.938 175.079 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -57.96 -50.51 73.14 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.769 -0.582 . . . . 0.0 109.892 169.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 23.9 mm -60.18 -25.21 32.79 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 O-C-N 121.655 -0.653 . . . . 0.0 111.04 176.644 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 60.8 m -77.88 -32.94 52.15 Favored 'General case' 0 C--O 1.224 -0.24 0 O-C-N 120.917 -1.115 . . . . 0.0 110.37 173.4 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 30.8 t80 -58.46 -55.25 37.47 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 170.293 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 53.1 mt -63.09 -43.19 99.21 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 121.411 0.624 . . . . 0.0 111.7 178.09 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.88 -43.7 97.18 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.685 -0.966 . . . . 0.0 110.685 -177.63 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.29 -46.74 85.37 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 123.186 0.595 . . . . 0.0 110.031 174.253 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 13.8 tp -49.55 -56.18 10.82 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.426 0.631 . . . . 0.0 109.963 175.7 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 81' ' ' ALA . . . . . 0.425 ' HB1' HD11 ' A' ' 13' ' ' ILE . . . -51.81 -58.63 5.87 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 114.624 -1.171 . . . . 0.0 110.384 177.438 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 48.3 ttm -51.01 -48.4 61.43 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 124.889 1.276 . . . . 0.0 110.983 -177.746 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 76.6 mt -63.8 -66.07 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 CA-C-O 118.8 -0.619 . . . . 0.0 109.458 -178.494 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.381 0.7 OUTLIER -70.13 -31.29 68.74 Favored 'General case' 0 C--N 1.345 0.411 0 C-N-CA 117.941 -1.504 . . . . 0.0 112.715 -169.764 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 22.5 m-80 -80.61 71.73 7.5 Favored 'General case' 0 C--O 1.231 0.12 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 170.03 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -35.75 -45.22 0.37 Allowed 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 125.821 1.648 . . . . 0.0 112.158 178.172 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -35.74 -48.61 0.55 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.968 1.707 . . . . 0.0 113.426 174.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 96.4 mt -65.06 -26.91 68.44 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.002 0.521 . . . . 0.0 112.393 -176.332 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 9.6 mtmp? -86.6 -47.32 9.3 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.381 0.672 . . . . 0.0 109.419 174.698 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.202 0 CA-C-O 116.883 -2.065 . . . . 0.0 110.262 -179.005 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.4 ttt . . . . . 0 N--CA 1.473 0.723 0 CA-C-O 121.382 0.611 . . . . 0.0 109.986 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -72.75 78.53 1.12 Allowed 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.025 0.53 . . . . 0.0 110.917 -176.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.4 t -44.87 155.63 0.39 Allowed Pre-proline 0 CA--C 1.534 0.336 0 C-N-CA 124.989 1.316 . . . . 0.0 111.08 169.441 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -50.23 -38.92 52.45 Favored 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 122.331 2.021 . . . . 0.0 111.533 169.47 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.9 mt -61.28 -54.0 49.62 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 118.649 0.659 . . . . 0.0 110.142 173.631 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -58.35 -38.96 78.26 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 117.656 0.207 . . . . 0.0 110.832 -175.821 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 15.1 tt0 -64.02 -52.3 60.12 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 124.783 1.233 . . . . 0.0 110.615 176.522 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.34 -45.42 91.29 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 121.367 0.603 . . . . 0.0 111.098 -178.126 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 68.0 mt -52.63 -52.63 25.43 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 169.405 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.4 -47.47 16.78 Favored Glycine 0 CA--C 1.528 0.893 0 C-N-CA 125.204 1.383 . . . . 0.0 112.202 174.732 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.6 mt -56.89 -55.31 36.08 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 117.95 0.875 . . . . 0.0 110.8 174.398 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.9 mp -59.37 -42.8 92.47 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 118.707 0.685 . . . . 0.0 111.7 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 73.5 mt -55.94 -56.82 10.71 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.167 0 C-N-CA 123.959 0.904 . . . . 0.0 109.746 172.659 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.29 -48.58 63.5 Favored Glycine 0 CA--C 1.522 0.518 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 -176.577 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 6.3 mm -54.73 -46.63 74.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 C-N-CA 123.396 0.678 . . . . 0.0 110.527 175.166 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -57.95 -53.45 58.04 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.645 0.736 . . . . 0.0 110.187 175.447 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.5 t-80 -57.43 -36.61 71.58 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.673 0.789 . . . . 0.0 111.302 -175.701 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.8 ttmm -52.86 -28.5 23.29 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.026 1.33 . . . . 0.0 111.87 178.25 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 61.3 m-85 -117.61 -73.52 0.64 Allowed 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.36 0.664 . . . . 0.0 109.602 176.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -53.35 -48.77 68.23 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 124.513 1.125 . . . . 0.0 110.432 -175.683 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -65.63 -4.84 20.74 Favored Glycine 0 CA--C 1.522 0.53 0 CA-C-O 118.598 -1.112 . . . . 0.0 113.615 -175.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 13.5 mmmm -85.41 -31.19 23.02 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 118.961 1.381 . . . . 0.0 111.103 173.853 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -82.77 152.04 25.88 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 118.623 0.647 . . . . 0.0 109.271 176.661 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -54.55 -40.29 69.38 Favored Glycine 0 CA--C 1.528 0.906 0 C-N-CA 123.436 0.541 . . . . 0.0 111.952 -173.655 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 11.8 p-10 -79.07 62.05 3.38 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.014 0.926 . . . . 0.0 109.15 174.397 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -52.27 -28.84 20.38 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.366 1.466 . . . . 0.0 113.208 -169.799 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 20.1 t-160 -76.25 -14.14 60.14 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.6 1.56 . . . . 0.0 111.656 -176.422 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.5 p -131.64 159.88 37.02 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 124.015 0.926 . . . . 0.0 112.178 -169.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.48 -172.31 3.5 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.411 1.484 . . . . 0.0 108.178 171.178 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 8.6 t -148.17 -168.93 3.21 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 119.899 1.227 . . . . 0.0 111.828 178.584 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 49.0 pttt -35.15 -57.14 0.58 Allowed 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 128.992 2.917 . . . . 0.0 114.376 -173.342 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 23.1 ttmm -58.3 -52.37 65.88 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 -177.426 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -63.22 -40.48 97.59 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.274 -176.54 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.2 mt -59.77 -52.71 64.32 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 118.133 0.424 . . . . 0.0 111.178 175.221 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 35.3 mtmm -59.91 -43.36 94.92 Favored 'General case' 0 CA--C 1.531 0.212 0 O-C-N 122.202 -0.311 . . . . 0.0 110.706 -179.783 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 85.1 mt-10 -56.87 -60.22 3.89 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-O 118.746 -0.645 . . . . 0.0 109.8 172.266 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.0 mt -40.11 -60.6 1.02 Allowed 'General case' 0 N--CA 1.461 0.096 0 C-N-CA 124.481 1.113 . . . . 0.0 111.323 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 18.3 tt -60.94 -51.54 72.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 C-N-CA 120.179 -0.608 . . . . 0.0 110.29 -177.068 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -59.92 -47.55 85.3 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 118.868 0.758 . . . . 0.0 111.815 -175.403 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.2 mmpt? -67.95 -57.98 5.29 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 125.539 1.535 . . . . 0.0 109.642 -176.196 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -83.25 -49.23 9.63 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.198 -168.445 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 15.0 mt -82.46 63.77 6.79 Favored 'General case' 0 C--O 1.231 0.086 0 N-CA-C 108.056 -1.091 . . . . 0.0 108.056 171.207 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.2 t -74.61 56.48 0.69 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.434 1.094 . . . . 0.0 109.579 174.08 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 16.2 mt -70.14 -40.99 78.89 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 C-N-CA 123.993 0.917 . . . . 0.0 109.045 176.602 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.0 -66.14 2.19 Favored Glycine 0 C--N 1.338 0.693 0 N-CA-C 110.413 -1.075 . . . . 0.0 110.413 179.474 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 49.8 m -72.27 71.46 0.89 Allowed 'General case' 0 N--CA 1.456 -0.159 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 170.308 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 46.2 mttm -52.46 97.12 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.673 1.189 . . . . 0.0 111.113 -173.084 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.4 mt -56.57 128.35 35.83 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.529 1.131 . . . . 0.0 112.842 -169.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? 60.65 -93.72 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.803 1.641 . . . . 0.0 111.841 168.498 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -148.42 -37.87 0.18 Allowed 'General case' 0 CA--C 1.528 0.133 0 C-N-CA 124.044 0.938 . . . . 0.0 111.761 177.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.92 -60.5 0.16 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.124 1.77 . . . . 0.0 115.115 -176.2 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -62.55 -40.18 95.99 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-O 121.421 0.629 . . . . 0.0 110.845 -174.695 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.649 HD12 ' H ' ' A' ' 53' ' ' ILE . 3.4 mp -67.54 -48.42 76.94 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 -178.936 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 84.6 t -55.13 -44.66 75.53 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.36 0 CA-C-O 118.791 -0.623 . . . . 0.0 110.294 176.357 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -57.09 -52.68 64.33 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 119.339 0.972 . . . . 0.0 110.577 174.01 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 39.7 mt -52.99 -42.12 65.26 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 119.06 -0.495 . . . . 0.0 111.557 178.205 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 25.4 mmt -68.63 -61.56 1.77 Allowed 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.886 0.766 . . . . 0.0 109.554 176.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -46.12 -36.04 5.51 Favored 'General case' 0 CA--C 1.521 -0.143 0 C-N-CA 127.639 2.375 . . . . 0.0 111.973 -176.073 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -39.16 -56.75 1.43 Allowed 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.831 0.853 . . . . 0.0 111.605 170.733 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.25 -50.08 74.85 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 -176.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -58.25 -54.9 41.73 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.522 0.729 . . . . 0.0 111.189 -177.398 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 16.9 ptt180 -70.24 -43.15 71.17 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 122.493 -0.129 . . . . 0.0 110.789 -173.154 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 22.8 m120 -75.71 -57.73 3.71 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 119.251 -0.404 . . . . 0.0 110.405 -177.368 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . 0.319 16.9 ptpt 52.26 -73.84 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.659 1.584 . . . . 0.0 112.386 -167.949 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -146.91 35.08 0.92 Allowed 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.894 1.277 . . . . 0.0 110.373 170.059 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 58.7 tp60 -119.74 137.56 53.87 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 125.421 1.488 . . . . 0.0 109.697 -175.215 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.8 mp0 -77.7 141.92 39.08 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 124.193 0.997 . . . . 0.0 109.05 172.576 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 33.9 m -105.73 154.56 6.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 108.239 -1.022 . . . . 0.0 108.239 170.071 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -93.35 178.11 5.82 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 123.946 0.898 . . . . 0.0 110.967 177.114 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 50.3 t80 -40.51 -65.41 0.42 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.756 1.222 . . . . 0.0 112.538 172.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -61.21 -36.54 80.19 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 120.074 1.306 . . . . 0.0 111.844 -175.774 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 -66.55 -32.87 74.48 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 120.956 -1.09 . . . . 0.0 111.628 176.089 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -61.61 -51.89 66.65 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 121.19 -0.944 . . . . 0.0 108.559 168.499 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 21.3 mm -53.02 -39.69 33.91 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.364 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 177.713 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 54.6 m -59.1 -32.83 70.18 Favored 'General case' 0 C--O 1.226 -0.167 0 C-N-CA 123.744 0.818 . . . . 0.0 111.301 177.858 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -56.97 -50.55 72.3 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 171.692 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 42.9 mt -69.83 -39.82 76.24 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.018 0.927 . . . . 0.0 111.755 -177.375 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.72 -43.04 77.45 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 109.925 -1.27 . . . . 0.0 109.925 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.47 -45.95 88.44 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 122.104 -0.644 . . . . 0.0 110.202 173.876 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 10.0 tp -50.53 -57.69 7.54 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.04 0.536 . . . . 0.0 109.708 173.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -49.67 -54.14 20.36 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 124.072 0.949 . . . . 0.0 110.533 177.12 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 48.1 ttm -56.16 -47.94 77.27 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 124.248 1.019 . . . . 0.0 110.906 -177.116 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 85.5 mt -65.48 -55.43 20.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.477 -177.134 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.444 0.1 OUTLIER -75.22 -35.8 61.44 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 119.911 1.232 . . . . 0.0 112.997 -174.408 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 31.9 m-80 -81.75 72.85 8.8 Favored 'General case' 0 N--CA 1.461 0.105 0 O-C-N 120.942 -1.099 . . . . 0.0 108.123 170.653 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -30.17 -50.77 0.13 Allowed 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 126.633 1.973 . . . . 0.0 112.837 -179.277 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -34.11 -54.46 0.49 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.202 1.801 . . . . 0.0 113.146 174.264 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 94.7 mt -65.72 -7.17 14.17 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.086 0.954 . . . . 0.0 113.245 -173.617 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -69.82 -31.53 69.46 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 120.005 1.275 . . . . 0.0 110.104 169.616 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.127 0 CA-C-O 116.949 -2.029 . . . . 0.0 111.061 -177.42 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.801 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -58.62 86.32 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.838 1.255 . . . . 0.0 110.066 173.474 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -71.07 170.29 11.94 Favored Pre-proline 0 CA--C 1.539 0.526 0 C-N-CA 124.616 1.167 . . . . 0.0 111.101 -169.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -49.09 -49.01 16.37 Favored 'Trans proline' 0 N--CA 1.459 -0.554 0 C-N-CA 123.313 2.675 . . . . 0.0 112.428 179.426 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.5 mt -53.7 -50.9 64.88 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 119.32 -0.372 . . . . 0.0 111.551 172.731 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -59.38 -41.23 88.86 Favored 'General case' 0 C--O 1.227 -0.11 0 CA-C-N 118.539 0.608 . . . . 0.0 110.285 -177.376 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -61.66 -50.32 72.98 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 122.832 0.453 . . . . 0.0 110.69 176.667 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.21 -46.13 90.8 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.597 0.759 . . . . 0.0 111.164 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 78.5 mt -55.64 -50.87 64.18 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 172.083 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.69 -47.68 18.11 Favored Glycine 0 CA--C 1.527 0.787 0 C-N-CA 125.295 1.426 . . . . 0.0 111.896 174.438 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.3 mt -55.52 -54.59 42.06 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 117.538 0.669 . . . . 0.0 111.087 173.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.5 mp -58.21 -42.76 86.93 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 118.851 0.751 . . . . 0.0 111.616 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 97.4 mt -56.98 -53.32 44.48 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.168 0 C-N-CA 123.204 0.602 . . . . 0.0 110.082 173.59 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.77 -50.06 59.42 Favored Glycine 0 CA--C 1.522 0.525 0 N-CA-C 110.33 -1.108 . . . . 0.0 110.33 -178.423 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.8 mm -55.02 -45.84 76.96 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 C-N-CA 122.607 0.363 . . . . 0.0 110.28 175.48 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 39.7 t80 -56.94 -57.8 10.92 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 118.537 0.608 . . . . 0.0 110.111 176.351 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -51.66 -41.39 61.33 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 124.497 1.119 . . . . 0.0 111.128 -177.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 65.3 tttp -50.24 -32.63 17.12 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.337 1.055 . . . . 0.0 112.293 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -113.66 -55.17 2.54 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.495 0.718 . . . . 0.0 110.643 179.495 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 4.6 t -59.75 -38.11 80.85 Favored 'General case' 0 C--O 1.232 0.139 0 C-N-CA 124.159 0.984 . . . . 0.0 111.247 -178.481 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -75.89 37.05 1.25 Allowed Glycine 0 CA--C 1.527 0.84 0 O-C-N 121.754 -0.592 . . . . 0.0 113.788 -173.005 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 43.2 mttm -124.75 -20.75 4.96 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 126.636 1.975 . . . . 0.0 109.91 168.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -67.65 166.69 14.57 Favored 'General case' 0 N--CA 1.452 -0.325 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -65.23 -64.5 3.46 Favored Glycine 0 CA--C 1.528 0.844 0 N-CA-C 108.988 -1.645 . . . . 0.0 108.988 171.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 56.3 t0 -79.69 83.99 5.58 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 172.238 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 56.5 mttp -60.27 -13.13 11.07 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.684 1.194 . . . . 0.0 113.803 -175.209 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 16.8 t-160 -75.65 -14.62 60.37 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.164 0.986 . . . . 0.0 110.343 174.194 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 35.9 p -122.34 153.09 39.45 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 124.723 1.209 . . . . 0.0 112.609 -179.266 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -155.12 -174.68 5.08 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.672 1.589 . . . . 0.0 107.919 170.596 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 9.1 t -147.02 -167.47 2.78 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 120.155 1.343 . . . . 0.0 112.63 -177.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -39.96 -53.87 2.28 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 127.725 2.41 . . . . 0.0 113.474 -169.516 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -56.87 -50.57 72.09 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 123.015 0.526 . . . . 0.0 110.754 -179.042 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 19.4 mp0 -65.48 -38.1 88.78 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 -177.754 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 31.6 mt -66.45 -51.26 58.75 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 118.214 0.461 . . . . 0.0 111.268 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -54.91 -48.96 72.38 Favored 'General case' 0 N--CA 1.456 -0.175 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 176.385 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -52.61 -60.55 3.11 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 119.062 -0.494 . . . . 0.0 111.019 173.164 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 9.1 mt -43.04 -64.19 0.67 Allowed 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 124.466 1.106 . . . . 0.0 110.494 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 18.3 tt -63.22 -51.09 75.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 119.677 -0.809 . . . . 0.0 110.491 -174.737 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -67.91 -33.51 74.84 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.405 -0.809 . . . . 0.0 112.549 -171.267 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.43 -68.16 0.67 Allowed 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 174.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 60.8 mm-40 -64.25 -44.38 91.96 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 122.158 -0.339 . . . . 0.0 110.667 -168.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 26.3 mt -100.73 51.06 0.87 Allowed 'General case' 0 N--CA 1.456 -0.144 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 172.235 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 7.6 t -54.42 -30.28 51.93 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 167.349 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 8.3 tt 41.48 44.72 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 127.161 2.184 . . . . 0.0 113.855 166.691 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.59 -59.58 2.91 Favored Glycine 0 CA--C 1.529 0.953 0 N-CA-C 110.094 -1.202 . . . . 0.0 110.094 -172.685 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 43.0 p -157.74 -89.83 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 117.708 0.754 . . . . 0.0 111.981 169.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -135.99 72.09 1.43 Allowed 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 -170.278 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 14.7 tp -58.42 120.41 8.72 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 115.717 -0.674 . . . . 0.0 112.072 -174.058 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 61.86 -101.42 0.11 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 126.449 1.9 . . . . 0.0 110.812 170.72 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -147.3 -42.24 0.18 Allowed 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 124.916 1.287 . . . . 0.0 109.946 -174.463 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -33.55 -60.83 0.35 Allowed 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 125.87 1.668 . . . . 0.0 114.142 -178.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 62.8 tt0 -58.91 -41.39 87.14 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-O 120.959 0.409 . . . . 0.0 110.852 -178.176 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 53' ' ' ILE . . . . . 0.516 ' H ' ' CD1' ' B' ' 53' ' ' ILE . 0.8 OUTLIER -64.59 -53.23 44.91 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.644 0 N-CA-C 106.665 -1.606 . . . . 0.0 106.665 -175.363 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 92.2 t -54.9 -45.58 75.62 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 C-N-CA 124.168 0.987 . . . . 0.0 110.082 177.005 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -55.75 -53.17 59.88 Favored 'General case' 0 CA--C 1.528 0.106 0 CA-C-N 118.538 0.608 . . . . 0.0 110.876 174.999 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 60.3 mt -55.85 -39.86 72.04 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 118.97 -0.538 . . . . 0.0 111.153 179.216 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 26.4 mmt -65.78 -65.6 0.66 Allowed 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.859 0.754 . . . . 0.0 109.186 174.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -39.3 -45.93 1.49 Allowed 'General case' 0 N--CA 1.461 0.124 0 C-N-CA 127.393 2.277 . . . . 0.0 111.892 -178.315 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -38.95 -48.3 1.57 Allowed 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 125.127 1.371 . . . . 0.0 112.227 178.015 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.2 pp -60.04 -39.89 87.52 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-O 119.641 -0.218 . . . . 0.0 110.827 -175.387 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -80.26 -42.81 22.47 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 123.005 0.522 . . . . 0.0 110.506 -178.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 54.7 ttm-85 -53.65 -45.73 70.32 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.328 0.651 . . . . 0.0 110.037 177.621 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 14.5 m-80 -80.7 -61.69 1.89 Allowed 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 178.38 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 36.5 ttmt 58.21 -82.92 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.194 1.398 . . . . 0.0 110.37 -172.367 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -142.2 36.03 1.53 Allowed 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.526 1.13 . . . . 0.0 109.678 173.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -136.45 146.12 45.99 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 125.007 1.323 . . . . 0.0 108.398 179.183 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 26.6 mp0 -70.66 166.0 21.7 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.148 0.979 . . . . 0.0 109.548 168.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 15.3 m -115.97 153.05 17.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 N-CA-C 106.106 -1.813 . . . . 0.0 106.106 167.369 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -96.82 174.83 6.6 Favored 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 123.085 0.554 . . . . 0.0 110.728 174.693 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -39.9 -60.23 1.05 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.065 0.946 . . . . 0.0 112.54 171.413 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 61.4 tp60 -60.48 -39.28 87.09 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 119.827 1.194 . . . . 0.0 111.835 -176.008 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 50.6 mm-40 -62.84 -41.37 99.32 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.322 -0.861 . . . . 0.0 111.339 174.141 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -56.7 -48.88 76.7 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.44 -0.787 . . . . 0.0 109.718 172.434 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 26.2 mm -59.42 -34.39 54.27 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 C-N-CA 123.725 0.81 . . . . 0.0 110.552 176.366 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 74.5 m -67.01 -41.91 85.88 Favored 'General case' 0 C--O 1.227 -0.121 0 O-C-N 121.479 -0.763 . . . . 0.0 110.204 174.373 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -56.72 -52.04 66.48 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.432 0.693 . . . . 0.0 109.225 174.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 44.0 mt -58.83 -44.64 90.96 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 122.246 -0.284 . . . . 0.0 111.59 175.042 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -59.5 -46.13 94.45 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 -179.366 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.09 -48.96 77.86 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 123.395 0.678 . . . . 0.0 109.804 176.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -50.69 -58.5 5.73 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-O 122.176 0.988 . . . . 0.0 109.733 176.201 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -48.69 -55.63 10.81 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 125.368 1.467 . . . . 0.0 110.742 178.126 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 19.7 ttp -66.58 -39.63 88.54 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.458 0.703 . . . . 0.0 112.087 -175.749 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 63.6 mt -65.49 -43.99 94.25 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 CA-C-O 118.02 -0.99 . . . . 0.0 110.079 -177.765 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.463 0.9 OUTLIER -78.75 -40.06 34.45 Favored 'General case' 0 C--N 1.347 0.459 0 C-N-CA 118.363 -1.335 . . . . 0.0 113.349 175.132 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -80.09 66.84 5.71 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 120.853 -1.154 . . . . 0.0 108.732 170.485 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -38.06 -42.65 0.67 Allowed 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.739 1.616 . . . . 0.0 113.328 -177.456 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -32.34 -55.07 0.33 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.25 1.82 . . . . 0.0 112.854 170.538 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 89.2 mt -62.23 -15.21 45.43 Favored 'General case' 0 C--O 1.222 -0.368 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 -173.213 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -65.61 -29.9 70.55 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.759 1.163 . . . . 0.0 111.195 174.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.202 0 CA-C-O 116.886 -2.064 . . . . 0.0 111.66 -174.034 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 45.3 ttp . . . . . 0 N--CA 1.477 0.877 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -67.05 81.25 0.12 Allowed 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.434 1.094 . . . . 0.0 110.907 -177.495 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.08 168.18 1.68 Allowed Pre-proline 0 CA--C 1.538 0.503 0 C-N-CA 126.598 1.959 . . . . 0.0 112.246 -178.384 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -49.05 -51.54 10.4 Favored 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 123.297 2.665 . . . . 0.0 112.491 174.703 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.423 HD23 ' HA ' ' A' ' 5' ' ' LEU . 5.8 mt -58.26 -49.18 78.02 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 119.436 -0.316 . . . . 0.0 110.705 176.597 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -54.99 -47.76 74.21 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -177.834 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 16.0 tt0 -59.72 -51.66 68.84 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.884 0.874 . . . . 0.0 110.757 177.35 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.33 -46.68 85.52 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.464 0.706 . . . . 0.0 111.725 -175.783 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 75.2 mt -54.21 -53.19 31.19 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 N-CA-C 107.958 -1.126 . . . . 0.0 107.958 170.478 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -45.6 -47.64 12.6 Favored Glycine 0 CA--C 1.529 0.92 0 C-N-CA 124.742 1.163 . . . . 0.0 112.087 175.07 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 mt -56.62 -54.3 47.63 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.785 0.834 . . . . 0.0 111.007 174.684 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.4 mp -60.03 -44.25 94.77 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.067 0.849 . . . . 0.0 111.743 -179.215 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 67.7 mt -56.18 -55.67 17.35 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 C-N-CA 123.238 0.615 . . . . 0.0 109.733 173.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -52.77 -50.73 48.54 Favored Glycine 0 CA--C 1.521 0.417 0 N-CA-C 110.03 -1.228 . . . . 0.0 110.03 -177.622 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.7 mm -55.0 -48.44 75.74 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 C-N-CA 123.03 0.532 . . . . 0.0 110.443 176.054 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -55.16 -56.15 23.2 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 118.668 0.667 . . . . 0.0 110.245 177.413 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -64.28 -31.96 73.37 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 123.19 0.596 . . . . 0.0 111.5 -172.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -49.77 -43.84 48.48 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.544 1.138 . . . . 0.0 110.828 176.824 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 94.5 m-85 -96.12 -56.05 2.77 Favored 'General case' 0 CA--C 1.529 0.138 0 N-CA-C 109.624 -0.509 . . . . 0.0 109.624 179.136 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.8 m -56.19 -31.58 63.57 Favored 'General case' 0 C--O 1.224 -0.267 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -175.572 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -51.17 -43.6 50.71 Favored Glycine 0 CA--C 1.527 0.829 0 O-C-N 121.667 -0.646 . . . . 0.0 112.36 175.729 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 15.8 pttm -86.36 53.23 2.73 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 118.042 0.921 . . . . 0.0 111.306 -174.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -165.0 154.78 13.26 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 126.014 1.726 . . . . 0.0 106.784 169.334 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -59.75 -52.19 54.48 Favored Glycine 0 CA--C 1.527 0.825 0 N-CA-C 111.292 -0.723 . . . . 0.0 111.292 -173.138 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 11.8 p-10 -79.51 54.1 1.69 Allowed 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.18 0.992 . . . . 0.0 110.665 -177.238 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -61.67 -9.8 7.04 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 115.699 1.74 . . . . 0.0 115.699 -169.198 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 16.5 m80 -78.53 -10.87 59.89 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.791 0.836 . . . . 0.0 110.578 175.315 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.4 p -138.89 164.51 29.48 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 127.059 2.144 . . . . 0.0 109.318 -174.041 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -161.61 163.2 30.12 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.829 0.852 . . . . 0.0 108.73 168.77 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 10.6 t -116.96 -169.64 1.68 Allowed 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.229 0.922 . . . . 0.0 112.639 -174.063 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -38.61 -65.49 0.35 Allowed 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 128.942 2.897 . . . . 0.0 113.252 -171.619 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 30.1 tttm -56.14 -43.54 78.36 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.386 0.674 . . . . 0.0 110.742 -174.427 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -66.41 -39.44 88.99 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 123.697 0.799 . . . . 0.0 110.387 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 45.8 mt -63.1 -50.65 69.66 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 118.123 0.42 . . . . 0.0 110.822 174.394 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 36.3 mttp -53.42 -49.26 67.69 Favored 'General case' 0 C--O 1.233 0.185 0 C-N-CA 123.584 0.754 . . . . 0.0 110.061 176.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 53.2 tt0 -51.56 -69.56 0.11 Allowed 'General case' 0 C--O 1.223 -0.335 0 CA-C-O 118.308 -0.853 . . . . 0.0 109.196 171.334 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.6 mt -35.26 -63.47 0.33 Allowed 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 124.126 0.971 . . . . 0.0 112.476 178.67 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 14.7 tt -63.85 -45.27 97.54 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-O 119.118 -0.468 . . . . 0.0 110.579 -171.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.0 tt0 -70.42 -44.75 67.28 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 118.856 0.753 . . . . 0.0 111.904 -176.433 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.7 mmpt? -54.85 -58.35 7.94 Favored 'General case' 0 N--CA 1.458 -0.069 0 C-N-CA 124.236 1.015 . . . . 0.0 109.103 175.842 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -79.56 -66.66 0.84 Allowed 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.715 -171.126 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 95.9 mt -87.99 56.32 3.82 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 121.615 -0.678 . . . . 0.0 109.916 -175.067 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.8 t -58.03 -33.34 68.87 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 168.191 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . 0.289 5.7 tt 43.37 68.47 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 C-N-CA 127.414 2.286 . . . . 0.0 112.224 168.32 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.15 -68.32 1.71 Allowed Glycine 0 CA--C 1.525 0.675 0 C-N-CA 125.306 1.431 . . . . 0.0 110.27 -179.14 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 30.9 t -173.64 55.89 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 125.925 1.69 . . . . 0.0 106.466 176.568 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 45.3 mttm 56.81 54.56 7.05 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.563 0.745 . . . . 0.0 110.88 -170.465 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.7 pp -66.57 133.45 50.35 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.146 -0.971 . . . . 0.0 110.361 174.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.2 tm0? 74.87 133.81 0.05 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 126.428 1.891 . . . . 0.0 110.968 178.044 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -47.0 -33.54 4.79 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 125.294 1.437 . . . . 0.0 114.552 -172.537 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -38.64 -56.2 1.35 Allowed 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.442 1.497 . . . . 0.0 113.737 -173.161 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -63.44 -38.93 93.04 Favored 'General case' 0 N--CA 1.461 0.106 0 CA-C-O 121.267 0.556 . . . . 0.0 110.709 -174.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.656 HD12 ' H ' ' A' ' 53' ' ' ILE . 3.0 mp -68.65 -49.47 64.42 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.705 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 -175.484 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 71.6 t -53.5 -47.39 59.6 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 C-N-CA 123.342 0.657 . . . . 0.0 110.172 173.371 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.54 -52.63 63.06 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.73 0.695 . . . . 0.0 110.607 176.212 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.1 mt -55.27 -40.47 71.03 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.266 0.626 . . . . 0.0 111.547 -178.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.24 -61.49 1.77 Allowed 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 118.563 0.62 . . . . 0.0 109.645 174.491 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -46.61 -34.0 4.63 Favored 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 126.5 1.92 . . . . 0.0 112.269 -176.714 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -38.12 -50.39 1.38 Allowed 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 125.302 1.441 . . . . 0.0 111.43 173.212 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -53.03 -60.53 3.17 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 122.81 0.444 . . . . 0.0 109.872 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -63.34 -40.28 96.85 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.569 0.747 . . . . 0.0 111.467 -174.631 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -79.4 -30.2 42.32 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 119.485 -0.293 . . . . 0.0 111.761 -173.642 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -77.32 -50.17 13.41 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 118.512 0.596 . . . . 0.0 109.996 173.733 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 82.2 mttt 55.37 41.99 30.56 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 -167.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 68.57 -36.83 0.33 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.443 1.897 . . . . 0.0 113.806 -174.57 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -50.84 133.78 26.1 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.617 0.644 . . . . 0.0 109.928 172.465 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.5 pm0 -59.81 154.74 17.68 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 123.341 0.656 . . . . 0.0 111.312 171.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 20.5 m -107.69 149.1 11.31 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 C-N-CA 126.034 1.734 . . . . 0.0 108.303 174.349 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -87.68 168.93 12.56 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.335 0.654 . . . . 0.0 111.283 175.214 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -33.59 -63.0 0.27 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.688 1.195 . . . . 0.0 112.963 172.024 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 45.2 tp60 -62.49 -31.46 72.22 Favored 'General case' 0 CA--C 1.533 0.292 0 O-C-N 120.753 -1.217 . . . . 0.0 111.839 -174.186 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -71.8 -37.74 70.36 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.261 -0.899 . . . . 0.0 110.199 176.2 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -56.67 -49.86 73.81 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 169.666 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 26.9 mm -56.59 -41.43 73.5 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 175.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 60.1 m -59.22 -41.7 89.26 Favored 'General case' 0 C--O 1.225 -0.196 0 CA-C-N 118.821 0.737 . . . . 0.0 110.489 177.579 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -54.46 -54.62 38.46 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 122.027 -0.421 . . . . 0.0 109.885 174.111 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 62.4 mt -61.12 -40.7 94.78 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.95 -44.48 67.66 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 110.386 -1.086 . . . . 0.0 110.386 -176.859 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.02 -44.3 93.0 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 117.942 0.871 . . . . 0.0 110.302 175.387 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 14.4 tp -50.94 -57.1 9.41 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 121.278 0.561 . . . . 0.0 109.659 173.109 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.36 -47.32 66.21 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.312 178.114 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 37.2 ttm -58.49 -46.64 86.25 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 123.963 0.905 . . . . 0.0 110.798 -179.105 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 63.6 mt -63.51 -62.99 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.162 0 CA-C-O 118.554 -0.736 . . . . 0.0 109.886 176.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.452 0.2 OUTLIER -68.16 -34.74 76.88 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 118.025 -1.47 . . . . 0.0 112.731 -169.868 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -83.91 66.84 9.34 Favored 'General case' 0 N--CA 1.462 0.149 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 167.628 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 82.9 mt-10 -41.78 -39.31 1.7 Allowed 'General case' 0 N--CA 1.463 0.209 0 C-N-CA 125.904 1.681 . . . . 0.0 112.028 -173.161 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.17 -50.94 0.31 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.848 1.659 . . . . 0.0 113.419 171.519 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 59.5 mt -61.27 -18.62 59.35 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.926 0.89 . . . . 0.0 113.32 -174.663 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -67.36 -16.78 64.45 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 118.962 0.801 . . . . 0.0 112.038 172.834 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.258 0 CA-C-O 116.176 -2.458 . . . . 0.0 112.23 -179.468 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 12.8 tpt . . . . . 0 N--CA 1.474 0.738 0 N-CA-C 110.334 -0.247 . . . . 0.0 110.334 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -78.02 70.49 4.4 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 176.554 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 3.8 m -55.66 161.5 3.16 Favored Pre-proline 0 CA--C 1.54 0.559 0 C-N-CA 123.211 0.605 . . . . 0.0 110.797 174.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -44.26 -49.64 8.58 Favored 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 123.615 2.877 . . . . 0.0 113.285 178.785 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 6.1 mt -53.99 -47.82 71.02 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-O 119.643 -0.218 . . . . 0.0 111.466 174.158 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -64.93 -42.29 94.8 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 109.8 -0.445 . . . . 0.0 109.8 -174.679 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 tp60 -61.46 -46.69 89.01 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 122.179 0.192 . . . . 0.0 110.682 175.48 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.84 -46.88 83.06 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.411 0.685 . . . . 0.0 111.165 -178.369 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 57.8 mt -52.54 -51.99 29.95 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 C-N-CA 124.177 0.991 . . . . 0.0 108.448 169.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.68 -48.46 23.17 Favored Glycine 0 CA--C 1.528 0.874 0 C-N-CA 124.971 1.272 . . . . 0.0 111.654 175.13 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 mt -56.03 -54.51 44.03 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 117.492 0.646 . . . . 0.0 111.027 174.362 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 mp -57.94 -44.81 87.16 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.053 0.842 . . . . 0.0 111.666 -179.48 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 96.2 mt -56.32 -54.01 33.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 C-N-CA 123.171 0.588 . . . . 0.0 110.263 173.721 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.27 -50.19 57.01 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 110.293 -1.123 . . . . 0.0 110.293 -178.045 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 9.1 mm -53.85 -48.52 62.12 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 C-N-CA 123.684 0.794 . . . . 0.0 110.549 176.019 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -55.47 -62.28 1.78 Allowed 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.326 0.584 . . . . 0.0 109.686 176.571 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -52.7 -41.16 63.64 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.312 1.045 . . . . 0.0 111.427 -174.572 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -47.58 -39.96 17.97 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.713 1.205 . . . . 0.0 111.43 178.257 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -96.89 -62.48 1.25 Allowed 'General case' 0 C--O 1.233 0.199 0 N-CA-C 109.044 -0.725 . . . . 0.0 109.044 178.446 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.4 m -49.2 -44.09 42.9 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 124.135 0.974 . . . . 0.0 111.975 -173.516 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -44.54 -38.16 5.26 Favored Glycine 0 C--N 1.339 0.726 0 C-N-CA 124.972 1.272 . . . . 0.0 113.068 -177.228 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -72.71 -23.74 60.9 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -170.853 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -79.58 6.76 9.71 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -168.59 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 79.61 -51.75 4.04 Favored Glycine 0 CA--C 1.528 0.881 0 O-C-N 120.589 -1.319 . . . . 0.0 110.102 -176.488 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -78.29 59.46 2.31 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 107.694 -1.225 . . . . 0.0 107.694 168.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 65.8 mttt -41.58 -37.89 1.23 Allowed 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 127.378 2.271 . . . . 0.0 115.738 -166.63 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 45.2 m80 -99.47 17.27 20.73 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 -173.218 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -138.63 160.22 40.14 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 126.039 1.735 . . . . 0.0 107.412 176.724 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.53 176.87 11.12 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-O 118.998 -0.525 . . . . 0.0 110.938 176.369 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 39.1 p -125.71 174.0 8.62 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.701 0.682 . . . . 0.0 112.491 -174.408 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 11.3 ptpt -26.39 -56.65 0.08 Allowed 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 127.889 2.476 . . . . 0.0 113.981 170.313 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -53.78 -52.58 59.79 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 123.136 0.574 . . . . 0.0 110.551 -178.424 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 26.0 mp0 -67.8 -37.2 81.7 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 118.693 -0.67 . . . . 0.0 110.391 -178.672 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 62.3 mt -62.11 -51.96 65.8 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.266 0.939 . . . . 0.0 111.108 178.11 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -61.93 -42.13 98.75 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 122.987 0.515 . . . . 0.0 110.002 -179.513 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 58.9 mt-10 -54.87 -67.01 0.3 Allowed 'General case' 0 C--O 1.222 -0.353 0 CA-C-O 119.302 -0.38 . . . . 0.0 110.299 169.731 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 12.7 mt -37.61 -63.38 0.46 Allowed 'General case' 0 CA--C 1.52 -0.184 0 C-N-CA 125.98 1.712 . . . . 0.0 111.224 -179.284 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 13.6 tt -57.26 -54.38 31.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.158 -174.667 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 -73.7 -31.32 63.35 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.994 0.738 . . . . 0.0 112.994 -170.417 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.9 -56.98 4.2 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 176.336 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 68.9 mm-40 -77.06 -26.65 53.8 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 117.911 -1.042 . . . . 0.0 112.628 -168.64 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 95.5 mt -98.14 96.15 7.91 Favored 'General case' 0 C--N 1.339 0.11 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 167.538 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 55.5 p -76.27 42.56 0.27 Allowed 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.884 0.874 . . . . 0.0 110.862 -179.763 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 60.2 mt -87.66 72.77 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 N-CA-C 106.47 -1.678 . . . . 0.0 106.47 -177.307 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -51.07 -33.95 30.62 Favored Glycine 0 CA--C 1.532 1.105 0 CA-C-N 115.858 -0.61 . . . . 0.0 112.208 178.684 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 3.0 p -67.58 -20.48 65.38 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 124.835 1.254 . . . . 0.0 113.365 178.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp 47.93 60.31 3.65 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.413 1.085 . . . . 0.0 110.427 -173.393 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 97.4 mt -29.41 -56.58 0.15 Allowed 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 127.102 2.161 . . . . 0.0 115.466 -169.059 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -153.27 157.49 40.23 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 106.748 -1.575 . . . . 0.0 106.748 -172.563 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -33.54 -43.09 0.12 Allowed 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 128.369 2.668 . . . . 0.0 114.111 -172.204 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -28.7 -60.13 0.13 Allowed 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 126.453 1.901 . . . . 0.0 113.561 -178.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -67.65 -39.81 84.56 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-O 120.889 0.376 . . . . 0.0 110.603 -172.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 53' ' ' ILE . . . . . 0.501 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.1 mp -62.05 -54.1 38.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 N-CA-C 106.931 -1.507 . . . . 0.0 106.931 179.213 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 70.9 t -58.71 -40.99 81.14 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 C-N-CA 124.452 1.101 . . . . 0.0 110.116 -177.813 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -58.19 -54.67 44.35 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 118.916 0.78 . . . . 0.0 110.307 172.198 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 36.7 mt -51.87 -41.87 62.21 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 119.231 -0.414 . . . . 0.0 111.606 178.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 24.0 mmt -69.56 -64.56 0.86 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 121.533 0.683 . . . . 0.0 109.988 177.331 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.65 -25.5 62.82 Favored 'General case' 0 N--CA 1.457 -0.088 0 C-N-CA 124.791 1.236 . . . . 0.0 112.293 -169.0 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -41.29 -50.09 3.69 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 124.273 1.029 . . . . 0.0 111.166 168.738 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 78.4 mt -59.08 -53.28 60.15 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -174.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -60.7 -44.03 97.07 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 124.582 1.153 . . . . 0.0 110.948 -179.067 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 29.4 ttm105 -59.05 -52.75 64.41 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.407 0.683 . . . . 0.0 110.108 178.457 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -76.14 -63.07 1.4 Allowed 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 116.663 -0.244 . . . . 0.0 110.372 -171.778 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 79.6 mttt 62.4 -75.31 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.261 1.425 . . . . 0.0 109.905 -167.764 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -143.21 8.37 1.61 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.435 1.494 . . . . 0.0 111.359 175.072 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -94.03 135.53 35.28 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.629 1.172 . . . . 0.0 108.43 -175.546 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -81.05 150.47 28.81 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 168.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 15.2 m -106.39 150.96 8.57 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 C-N-CA 124.697 1.199 . . . . 0.0 108.807 174.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -90.82 174.14 7.62 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.861 0.864 . . . . 0.0 110.826 173.81 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -39.06 -62.11 0.68 Allowed 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.019 1.328 . . . . 0.0 112.883 173.566 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 39.0 tp60 -61.84 -35.33 77.94 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 119.603 1.092 . . . . 0.0 111.605 -173.111 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -66.21 -43.42 86.77 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.667 -0.646 . . . . 0.0 110.139 176.175 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -54.67 -48.33 72.5 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.867 -0.52 . . . . 0.0 109.896 171.806 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 25.5 mm -58.55 -37.8 66.95 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 O-C-N 121.889 -0.507 . . . . 0.0 110.355 175.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 37.5 m -62.99 -42.86 99.96 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 121.521 -0.737 . . . . 0.0 110.203 175.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -56.14 -55.07 37.54 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 122.958 0.503 . . . . 0.0 110.017 176.046 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 39.6 mt -60.64 -44.28 96.58 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 122.188 -0.32 . . . . 0.0 111.861 177.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.56 -39.64 95.64 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 111.059 -0.816 . . . . 0.0 111.059 -175.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.32 -50.53 72.56 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 117.541 0.67 . . . . 0.0 109.425 173.118 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -49.39 -54.69 16.07 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 121.445 0.64 . . . . 0.0 109.894 174.658 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.08 -56.85 11.8 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 124.487 1.115 . . . . 0.0 110.716 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 11.4 ttp -60.74 -45.55 93.85 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.656 0.782 . . . . 0.0 111.315 -177.484 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 63.3 mt -61.97 -47.75 91.74 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-O 117.916 -1.04 . . . . 0.0 110.216 -175.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.453 0.0 OUTLIER -83.2 -31.58 27.0 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 179.89 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 32.0 m-80 -80.11 77.55 6.81 Favored 'General case' 0 N--CA 1.462 0.126 0 O-C-N 120.715 -1.241 . . . . 0.0 108.749 173.709 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 55.0 mm-40 -36.71 -43.29 0.41 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 126.024 1.729 . . . . 0.0 112.466 178.008 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -41.46 -41.19 1.99 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 126.185 1.794 . . . . 0.0 113.734 176.419 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 90.5 mt -75.35 -16.52 60.39 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -177.278 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 9.8 mtmp? -102.0 -44.66 5.41 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.295 1.038 . . . . 0.0 110.689 179.678 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.158 0 CA-C-O 117.424 -1.764 . . . . 0.0 110.329 -177.223 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 68.5 mtm . . . . . 0 N--CA 1.474 0.761 0 CA-C-O 120.407 0.146 . . . . 0.0 110.976 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -67.66 77.7 0.19 Allowed 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 121.894 0.854 . . . . 0.0 109.706 176.854 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 13.6 m -60.01 160.87 14.2 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 125.93 1.692 . . . . 0.0 109.717 -177.659 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo -48.61 -49.41 14.79 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.977 2.451 . . . . 0.0 112.92 -176.779 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.6 mt -58.83 -41.25 86.45 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 173.374 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -63.04 -40.79 98.77 Favored 'General case' 0 C--O 1.225 -0.201 0 CA-C-N 118.979 0.809 . . . . 0.0 109.389 -178.902 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -60.24 -51.87 67.72 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 122.753 0.421 . . . . 0.0 110.427 174.487 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.56 -46.87 88.59 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 121.563 0.697 . . . . 0.0 111.639 -177.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 60.6 mt -55.23 -50.8 61.6 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 171.582 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -48.06 -46.96 26.79 Favored Glycine 0 CA--C 1.526 0.747 0 C-N-CA 125.157 1.361 . . . . 0.0 111.688 176.029 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.6 mt -54.85 -55.93 24.95 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.775 0.83 . . . . 0.0 110.916 173.874 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 11.0 mp -60.35 -43.87 96.08 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.546 -0.721 . . . . 0.0 111.914 -179.025 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 96.1 mt -55.34 -56.16 13.04 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.206 0 C-N-CA 123.226 0.611 . . . . 0.0 109.592 173.431 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -52.77 -49.72 52.78 Favored Glycine 0 CA--C 1.522 0.483 0 N-CA-C 110.356 -1.098 . . . . 0.0 110.356 -177.271 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 7.9 mm -53.4 -46.94 59.05 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 C-N-CA 122.694 0.398 . . . . 0.0 110.84 176.216 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 29.3 t80 -58.87 -60.35 3.98 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 121.939 0.876 . . . . 0.0 109.8 176.342 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.1 t-80 -55.41 -34.14 64.15 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 125.468 1.507 . . . . 0.0 111.871 -172.466 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 65.3 tttp -46.68 -36.69 7.37 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.586 1.154 . . . . 0.0 111.567 174.425 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -104.88 -62.61 1.32 Allowed 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 176.002 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.5 m -51.4 -34.77 36.09 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 124.74 1.216 . . . . 0.0 112.705 -171.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -43.67 -33.66 2.45 Favored Glycine 0 C--N 1.34 0.757 0 C-N-CA 124.062 0.839 . . . . 0.0 113.222 178.511 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.02 -37.38 1.28 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.282 0.633 . . . . 0.0 112.265 178.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -78.68 69.3 4.84 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 121.432 -0.792 . . . . 0.0 109.984 -176.715 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 121.63 -103.15 0.85 Allowed Glycine 0 CA--C 1.523 0.566 0 N-CA-C 107.667 -2.173 . . . . 0.0 107.667 -176.451 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -155.6 152.57 28.91 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 173.258 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.42 -20.71 1.92 Allowed 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 -178.592 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 22.6 t-160 -89.4 -29.47 19.05 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 113.793 1.034 . . . . 0.0 113.793 172.781 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 36.4 p -138.3 139.77 39.26 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 -168.547 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -145.65 -172.84 3.98 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.413 1.085 . . . . 0.0 108.92 169.42 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 96.5 p -147.21 -179.86 7.13 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.813 1.188 . . . . 0.0 113.188 -170.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -19.18 -71.3 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 128.922 2.889 . . . . 0.0 115.132 -178.287 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.1 ttpt -60.38 -44.76 95.34 Favored 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 121.88 -0.512 . . . . 0.0 109.879 -172.719 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -59.97 -40.98 90.95 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 123.199 0.6 . . . . 0.0 110.084 177.616 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 38.0 mt -65.2 -49.99 67.61 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 118.121 0.419 . . . . 0.0 111.365 178.862 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -57.6 -51.25 70.25 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 178.075 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 59.1 tt0 -48.4 -57.75 5.6 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.988 1.315 . . . . 0.0 109.751 173.462 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.3 mt -46.36 -72.94 0.05 OUTLIER 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 124.306 1.043 . . . . 0.0 110.247 176.017 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 18.8 tt -55.54 -42.53 68.75 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 CA-C-N 117.787 0.267 . . . . 0.0 110.533 -169.657 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -56.38 -51.37 68.58 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.83 -0.544 . . . . 0.0 111.618 174.544 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.29 -54.07 24.1 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 118.12 0.418 . . . . 0.0 110.596 -174.04 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.14 -9.12 43.61 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -169.771 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 23.1 mt -129.81 69.27 1.43 Allowed 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 170.801 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 16.6 p -66.25 80.43 0.09 Allowed 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 169.49 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 9.6 tp -75.65 53.76 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 126.946 2.098 . . . . 0.0 112.153 -168.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 56.13 -82.73 0.01 OUTLIER Glycine 0 C--N 1.34 0.757 0 C-N-CA 126.955 2.217 . . . . 0.0 111.857 -178.329 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 35.3 m -154.58 46.46 0.56 Allowed 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 124.785 1.234 . . . . 0.0 108.61 174.657 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 8.7 mtmp? 75.63 61.55 0.05 Allowed 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 126.116 1.766 . . . . 0.0 110.118 -175.598 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 18.0 mt -47.3 -50.97 20.52 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 -178.594 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -152.8 143.1 22.51 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 -168.351 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -36.41 -43.54 0.39 Allowed 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 127.781 2.432 . . . . 0.0 115.523 -169.695 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -32.62 -62.01 0.25 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.535 1.534 . . . . 0.0 114.563 -174.665 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -65.23 -36.0 82.79 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-O 120.796 0.331 . . . . 0.0 111.093 -174.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.566 ' N ' HD12 ' A' ' 53' ' ' ILE . 1.3 mp -66.59 -52.75 42.55 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 N-CA-C 105.941 -1.874 . . . . 0.0 105.941 -176.267 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 86.4 t -53.38 -45.01 56.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 C-N-CA 124.173 0.989 . . . . 0.0 109.922 174.735 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.1 -50.39 73.65 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 118.92 0.782 . . . . 0.0 111.444 176.181 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 54.9 mt -56.06 -39.87 72.7 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 119.151 -0.452 . . . . 0.0 111.038 178.037 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 24.7 mmt -67.49 -60.35 2.64 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.808 0.731 . . . . 0.0 109.457 175.635 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -46.83 -40.17 13.31 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 126.89 2.076 . . . . 0.0 111.697 -176.23 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -38.78 -48.98 1.58 Allowed 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 124.908 1.283 . . . . 0.0 111.842 174.891 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 73.1 mt -58.45 -54.23 49.41 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.792 -0.448 . . . . 0.0 109.792 -176.31 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -66.01 -40.15 90.86 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 124.092 0.957 . . . . 0.0 111.275 -178.029 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 17.4 ttm180 -59.59 -48.97 79.59 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 123.895 0.878 . . . . 0.0 109.585 178.254 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -80.56 -69.74 0.58 Allowed 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 120.621 0.248 . . . . 0.0 110.578 -175.442 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 22.4 mtmm 63.9 -72.24 0.06 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 126.018 1.727 . . . . 0.0 108.152 -166.515 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -137.43 -18.62 1.26 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.172 1.789 . . . . 0.0 111.881 171.137 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.01 109.42 6.53 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 123.536 0.734 . . . . 0.0 110.26 -174.38 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -53.65 125.8 19.55 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 169.21 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 11.0 m -80.37 139.79 17.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 -179.047 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -83.17 172.09 13.0 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 120.988 0.423 . . . . 0.0 111.232 176.385 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -41.61 -59.48 1.62 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.577 1.151 . . . . 0.0 111.827 173.08 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 36.0 tp60 -61.12 -38.87 87.89 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 119.11 0.868 . . . . 0.0 111.564 -175.6 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -60.94 -44.6 97.02 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.532 -0.73 . . . . 0.0 110.807 174.347 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -58.08 -47.62 82.65 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 121.699 -0.626 . . . . 0.0 109.961 174.115 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.7 mm -59.08 -33.51 50.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 O-C-N 121.704 -0.622 . . . . 0.0 110.174 175.315 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 41.8 m -69.24 -36.2 76.92 Favored 'General case' 0 C--O 1.224 -0.287 0 O-C-N 121.448 -0.782 . . . . 0.0 110.402 173.617 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -58.52 -56.88 16.4 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 173.85 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 33.1 mt -60.7 -45.2 95.09 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 122.451 0.3 . . . . 0.0 111.781 178.461 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.65 -43.97 95.64 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.742 -0.943 . . . . 0.0 110.742 -176.581 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.02 -45.48 81.36 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 121.961 -0.729 . . . . 0.0 110.139 176.521 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -48.73 -55.71 10.66 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.469 0.708 . . . . 0.0 109.872 171.931 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -53.37 -54.8 31.4 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 124.28 1.032 . . . . 0.0 111.092 178.114 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 21.7 ttp -63.02 -36.26 82.97 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 123.995 0.918 . . . . 0.0 111.774 -176.83 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 83.1 mt -64.31 -60.66 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 176.134 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.439 0.2 OUTLIER -67.79 -35.7 79.11 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 117.188 -1.805 . . . . 0.0 112.638 -173.374 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 44.6 m-80 -80.1 65.8 5.37 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 169.414 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -35.38 -46.94 0.4 Allowed 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 126.413 1.885 . . . . 0.0 111.968 -176.26 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -27.64 -58.25 0.11 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.711 2.004 . . . . 0.0 113.307 171.275 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.7 mt -60.48 -19.5 56.9 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -172.243 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -67.68 -29.85 69.23 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 119.008 0.822 . . . . 0.0 111.488 174.174 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.207 0 CA-C-O 117.491 -1.727 . . . . 0.0 112.845 -169.703 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 5.0 ppp? . . . . . 0 N--CA 1.475 0.794 0 CA-C-O 119.862 -0.113 . . . . 0.0 110.806 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -110.35 99.34 8.38 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.777 0.831 . . . . 0.0 108.952 178.473 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 46.1 p -69.66 166.7 28.85 Favored Pre-proline 0 N--CA 1.452 -0.366 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 171.716 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_exo -49.37 -44.95 32.43 Favored 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 122.438 2.092 . . . . 0.0 110.986 168.616 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.431 HD23 ' HA ' ' B' ' 5' ' ' LEU . 2.1 mt -56.28 -58.36 8.3 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 118.621 -0.704 . . . . 0.0 112.475 170.678 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -56.61 -38.8 72.56 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 119.162 0.892 . . . . 0.0 110.481 -174.343 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 -61.4 -51.47 68.61 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.952 0.901 . . . . 0.0 111.194 173.843 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.73 -46.2 90.66 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.631 0.729 . . . . 0.0 111.362 -178.364 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 82.4 mt -53.03 -52.1 32.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 C-N-CA 124.597 1.159 . . . . 0.0 108.048 169.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.53 -47.66 22.93 Favored Glycine 0 CA--C 1.527 0.818 0 C-N-CA 124.94 1.257 . . . . 0.0 111.903 174.211 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.6 mt -54.48 -56.47 18.42 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.719 0.808 . . . . 0.0 110.408 173.292 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -56.79 -43.31 80.77 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 118.663 0.665 . . . . 0.0 111.69 -179.531 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 99.3 mt -58.42 -54.41 33.26 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 C-N-CA 123.007 0.523 . . . . 0.0 110.681 173.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.76 -49.93 67.08 Favored Glycine 0 CA--C 1.522 0.519 0 N-CA-C 110.313 -1.115 . . . . 0.0 110.313 -177.156 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 8.1 mm -51.25 -51.66 22.23 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 C-N-CA 124.182 0.993 . . . . 0.0 109.843 173.812 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -54.17 -56.44 18.21 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 110.172 -0.306 . . . . 0.0 110.172 177.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -58.04 -38.15 75.7 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 123.754 0.821 . . . . 0.0 111.241 -175.236 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 64.2 tttm -50.37 -42.82 53.92 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.824 0.849 . . . . 0.0 111.118 179.518 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -98.32 -30.42 12.6 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 122.781 0.432 . . . . 0.0 112.029 -178.365 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 14.2 m -69.6 -34.3 73.92 Favored 'General case' 0 C--O 1.226 -0.133 0 O-C-N 121.861 -0.524 . . . . 0.0 110.925 178.92 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -72.49 53.75 1.56 Allowed Glycine 0 CA--C 1.527 0.814 0 C-N-CA 124.597 1.094 . . . . 0.0 112.077 177.434 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt -147.72 -56.24 0.23 Allowed 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 124.939 1.295 . . . . 0.0 110.27 -177.692 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -127.28 161.41 28.65 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.254 1.021 . . . . 0.0 111.369 -168.14 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 54.91 -144.79 30.74 Favored Glycine 0 CA--C 1.529 0.938 0 C-N-CA 124.064 0.84 . . . . 0.0 111.912 175.016 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -78.73 132.6 37.02 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 105.369 -2.085 . . . . 0.0 105.369 168.659 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 28.0 mmtp -71.68 5.01 2.71 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 -168.716 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 14.7 m80 -113.99 20.93 15.32 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.588 1.155 . . . . 0.0 110.232 168.71 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 53.8 p -134.06 166.97 21.49 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 125.298 1.439 . . . . 0.0 107.522 169.602 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -160.77 160.25 31.05 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 171.55 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -100.93 176.74 5.17 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.42 1.488 . . . . 0.0 113.009 -169.589 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -42.72 -52.17 5.04 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 126.533 1.933 . . . . 0.0 113.825 179.13 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -62.81 -47.63 82.62 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 -175.22 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -59.29 -40.56 86.57 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.701 0.8 . . . . 0.0 111.187 177.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 35.5 mt -64.44 -48.1 76.58 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 118.471 0.578 . . . . 0.0 111.311 175.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 9.0 mtmp? -57.86 -43.24 85.83 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.951 -0.468 . . . . 0.0 110.297 175.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -55.28 -57.91 9.88 Favored 'General case' 0 C--O 1.224 -0.245 0 CA-C-O 119.189 -0.434 . . . . 0.0 110.553 171.076 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 10.7 mt -44.22 -59.39 2.38 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 123.898 0.879 . . . . 0.0 110.242 -179.643 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 16.0 tt -64.64 -51.43 67.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 C-N-CA 119.683 -0.807 . . . . 0.0 110.297 -177.47 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.24 -32.59 74.24 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 120.959 -1.088 . . . . 0.0 112.887 -172.42 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.11 -58.5 2.54 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.194 0.998 . . . . 0.0 109.937 177.611 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 49.7 mm-40 -82.78 -24.79 33.27 Favored 'General case' 0 CA--C 1.529 0.171 0 O-C-N 121.449 -0.782 . . . . 0.0 112.966 -168.395 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 58.4 mt -115.87 45.05 1.79 Allowed 'General case' 0 N--CA 1.46 0.065 0 C-N-CA 124.958 1.303 . . . . 0.0 108.02 169.593 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 1.8 t -56.21 -45.32 79.91 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 119.368 -0.349 . . . . 0.0 110.807 -173.259 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 63.5 mt 67.24 -56.69 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 C-N-CA 125.562 1.545 . . . . 0.0 113.623 169.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.98 -68.43 1.97 Allowed Glycine 0 CA--C 1.524 0.595 0 N-CA-C 109.438 -1.465 . . . . 0.0 109.438 -176.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 12.8 m -69.48 73.95 0.37 Allowed 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.314 1.046 . . . . 0.0 109.591 172.684 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 18.6 mmtm -45.99 93.29 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.105 1.762 . . . . 0.0 110.746 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 87.8 mt -51.42 -54.7 24.12 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 124.8 1.24 . . . . 0.0 112.114 -169.433 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -167.05 161.18 14.66 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 106.406 -1.702 . . . . 0.0 106.406 -172.299 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -37.03 -40.61 0.3 Allowed 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 128.024 2.53 . . . . 0.0 114.777 -171.53 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.4 -60.08 0.15 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.682 1.593 . . . . 0.0 114.45 -176.225 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 62.3 tt0 -63.55 -44.06 95.26 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 122.756 0.422 . . . . 0.0 110.81 -176.731 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 53' ' ' ILE . . . . . 0.484 ' H ' ' CD1' ' B' ' 53' ' ' ILE . 1.2 mp -59.96 -50.06 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.459 0 N-CA-C 106.461 -1.681 . . . . 0.0 106.461 -176.708 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 75.0 t -55.96 -54.62 24.84 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.535 176.528 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.41 -51.04 28.56 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 118.555 0.616 . . . . 0.0 111.764 -179.641 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 27.7 mt -52.19 -40.86 62.11 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 122.703 0.401 . . . . 0.0 112.06 -178.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -81.06 -58.48 3.05 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.625 0.77 . . . . 0.0 110.582 179.751 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -40.98 -42.61 1.93 Allowed 'General case' 0 N--CA 1.462 0.133 0 C-N-CA 126.484 1.914 . . . . 0.0 111.418 177.84 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -38.41 -51.64 1.55 Allowed 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 125.123 1.369 . . . . 0.0 112.897 174.693 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -58.15 -50.54 73.15 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -174.731 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -64.49 -49.04 72.92 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.683 0.393 . . . . 0.0 110.445 179.757 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 13.7 ttm180 -50.99 -54.2 26.49 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 124.113 0.965 . . . . 0.0 110.073 -179.154 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -68.08 -51.48 46.04 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 119.135 -0.46 . . . . 0.0 110.638 -179.513 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . 0.301 6.2 ptpp? 52.62 -74.55 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.933 1.693 . . . . 0.0 112.515 -169.167 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -146.82 34.69 0.92 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.039 1.336 . . . . 0.0 110.042 173.384 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -123.58 137.26 54.78 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.559 1.144 . . . . 0.0 110.009 -174.167 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -87.29 117.22 25.9 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 169.627 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 19.7 m -79.06 145.8 8.91 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.225 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 -177.328 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -82.77 177.7 8.54 Favored 'General case' 0 CA--C 1.528 0.133 0 C-N-CA 123.925 0.89 . . . . 0.0 111.377 177.752 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -48.16 -63.31 1.11 Allowed 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 123.963 0.905 . . . . 0.0 112.209 178.275 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 43.2 tp60 -61.99 -34.18 75.69 Favored 'General case' 0 CA--C 1.531 0.245 0 O-C-N 121.138 -0.976 . . . . 0.0 111.13 -174.03 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 61.3 mt-10 -63.24 -45.54 91.11 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 121.569 -0.707 . . . . 0.0 110.75 174.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -54.61 -49.11 71.24 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 121.645 -0.659 . . . . 0.0 109.98 170.799 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 22.4 mm -57.94 -34.47 48.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 O-C-N 121.689 -0.632 . . . . 0.0 110.343 176.417 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 33.2 m -67.9 -39.74 83.57 Favored 'General case' 0 CA--C 1.53 0.206 0 O-C-N 121.343 -0.848 . . . . 0.0 110.541 175.425 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -53.8 -55.19 28.7 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.656 -0.652 . . . . 0.0 109.63 171.614 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 34.9 mt -60.16 -45.32 93.46 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.791 178.707 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.0 -42.25 98.29 Favored Glycine 0 CA--C 1.524 0.623 0 N-CA-C 110.787 -0.925 . . . . 0.0 110.787 -176.507 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.43 -50.17 68.59 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 123.273 0.629 . . . . 0.0 110.108 175.719 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -48.14 -56.66 7.3 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 121.775 0.798 . . . . 0.0 110.136 173.521 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.81 -54.1 39.01 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.015 1.326 . . . . 0.0 110.695 179.825 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 50.1 ttm -57.32 -48.67 78.37 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.232 1.013 . . . . 0.0 110.619 -179.436 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 61.9 mt -63.36 -51.43 71.01 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-O 117.585 -1.198 . . . . 0.0 109.653 -174.212 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.436 0.8 OUTLIER -73.58 -39.69 64.46 Favored 'General case' 0 C--N 1.347 0.482 0 C-N-CA 118.15 -1.42 . . . . 0.0 112.707 -179.561 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -80.59 63.09 4.9 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 169.06 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -51.33 -25.22 5.58 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.102 0.961 . . . . 0.0 113.058 -172.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -39.55 -50.51 2.2 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.832 1.253 . . . . 0.0 111.49 167.107 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 86.1 mt -66.8 -3.37 6.63 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.689 1.196 . . . . 0.0 113.535 -176.748 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -73.55 -23.1 59.93 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 120.11 1.323 . . . . 0.0 109.732 168.825 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.2 0 CA-C-O 116.924 -2.042 . . . . 0.0 110.078 178.83 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.2 ptm . . . . . 0 N--CA 1.478 0.961 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -71.65 81.85 0.84 Allowed 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 177.393 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 70.0 p -54.4 162.93 1.44 Allowed Pre-proline 0 CA--C 1.533 0.319 0 C-N-CA 124.348 1.059 . . . . 0.0 111.21 174.03 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -47.99 -46.59 21.55 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.356 2.038 . . . . 0.0 110.676 168.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.466 HD23 ' HA ' ' A' ' 5' ' ' LEU . 4.7 mt -55.11 -59.28 4.98 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-O 119.26 -0.4 . . . . 0.0 111.716 173.257 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -52.55 -48.14 66.32 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.13 0.423 . . . . 0.0 110.336 -176.021 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.85 -49.98 75.27 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.499 0.72 . . . . 0.0 110.258 -179.558 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.49 -45.69 91.87 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.949 0.9 . . . . 0.0 111.99 -177.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 84.8 mt -55.14 -50.92 59.91 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 N-CA-C 107.737 -1.209 . . . . 0.0 107.737 171.574 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -45.56 -49.14 11.92 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 124.505 1.05 . . . . 0.0 112.033 172.449 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.6 mt -56.88 -55.15 38.16 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.055 0.927 . . . . 0.0 111.303 175.49 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -59.85 -44.42 94.13 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 119.293 0.951 . . . . 0.0 111.505 -177.491 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 77.8 mt -56.45 -53.71 37.25 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 123.523 0.729 . . . . 0.0 109.948 173.738 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -53.81 -49.29 58.9 Favored Glycine 0 CA--C 1.522 0.47 0 C-N-CA 124.443 1.021 . . . . 0.0 110.572 -179.124 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 7.3 mm -57.76 -44.53 86.1 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 C-N-CA 122.986 0.514 . . . . 0.0 110.185 176.588 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 39.6 t80 -55.81 -54.89 39.0 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 118.797 0.726 . . . . 0.0 109.89 175.647 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 37.4 m-70 -64.9 -26.78 68.46 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 113.48 0.918 . . . . 0.0 113.48 -177.029 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.2 ttmm -52.82 -26.11 13.53 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 118.694 0.679 . . . . 0.0 110.751 170.403 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -127.51 41.7 3.46 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.715 1.206 . . . . 0.0 109.118 173.174 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 31.9 m -38.27 103.18 0.03 OUTLIER 'General case' 0 C--N 1.348 0.512 0 C-N-CA 125.799 1.64 . . . . 0.0 112.408 -177.557 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -2.21 81.71 0.0 OUTLIER Glycine 0 C--N 1.34 0.775 0 C-N-CA 128.272 2.844 . . . . 0.0 114.646 177.503 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 44.2 mttp -73.68 -6.08 44.58 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 121.982 -0.716 . . . . 0.0 111.93 -169.226 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -77.41 52.28 0.94 Allowed 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.612 1.165 . . . . 0.0 109.713 176.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 70.31 -68.32 0.7 Allowed Glycine 0 CA--C 1.532 1.115 0 C-N-CA 124.316 0.96 . . . . 0.0 111.653 -174.552 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -79.65 113.36 17.74 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.892 0.877 . . . . 0.0 109.8 -177.616 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 40.4 mmtm -60.21 -16.76 36.21 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.926 1.29 . . . . 0.0 113.177 -177.141 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 21.4 t-160 -78.1 -12.39 59.99 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.742 0.817 . . . . 0.0 111.198 176.262 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 22.8 p -129.66 132.78 46.79 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 119.237 0.926 . . . . 0.0 113.256 -170.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -137.44 158.76 43.71 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.543 1.137 . . . . 0.0 110.77 176.824 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 88.8 p -117.71 -173.91 2.52 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.395 1.078 . . . . 0.0 112.8 -169.634 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 49.4 pttt -41.47 -54.53 3.09 Favored 'General case' 0 C--N 1.34 0.194 0 C-N-CA 126.144 1.778 . . . . 0.0 113.77 -177.821 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.84 -52.83 59.16 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 124.66 1.184 . . . . 0.0 108.457 -177.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -64.33 -38.59 91.57 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 123.723 0.809 . . . . 0.0 110.689 -177.441 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.4 HD12 ' CE2' ' A' ' 76' ' ' PHE . 2.7 mm? -60.95 -54.91 39.22 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 118.869 0.758 . . . . 0.0 111.299 175.245 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 53.4 mtmt -56.54 -48.53 77.06 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.067 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 62.9 tt0 -50.46 -59.0 4.45 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.174 0.989 . . . . 0.0 110.427 175.206 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mt -47.1 -65.87 0.5 Allowed 'General case' 0 C--O 1.232 0.165 0 C-N-CA 124.968 1.307 . . . . 0.0 110.411 177.88 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 16.7 tt -62.42 -45.7 98.17 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 C-N-CA 120.04 -0.664 . . . . 0.0 109.77 -170.458 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -58.72 -51.79 68.46 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 122.836 0.454 . . . . 0.0 111.404 -179.268 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -66.26 -57.66 7.06 Favored 'General case' 0 C--N 1.339 0.11 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 -177.517 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -71.96 -61.63 1.72 Allowed 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 -169.837 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 54.7 mt -88.82 63.5 6.86 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.447 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 5.3 t -72.82 48.72 0.21 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.376 1.07 . . . . 0.0 110.445 174.19 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 31.8 mt -78.5 83.0 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 N-CA-C 107.945 -1.132 . . . . 0.0 107.945 -174.23 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -46.98 -34.67 7.55 Favored Glycine 0 CA--C 1.534 1.228 0 C-N-CA 124.118 0.866 . . . . 0.0 112.209 172.88 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.1 m -59.04 -23.64 62.16 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.616 1.167 . . . . 0.0 113.807 176.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.47 ' HB3' HD11 ' A' ' 53' ' ' ILE . 34.9 mmtp 48.78 61.13 3.25 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 125.11 1.364 . . . . 0.0 111.175 179.808 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 84.4 mt -44.05 103.39 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.83 1.652 . . . . 0.0 113.325 -176.258 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 65.49 -76.64 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 126.505 1.922 . . . . 0.0 112.53 169.525 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -162.74 -40.01 0.04 OUTLIER 'General case' 0 C--O 1.226 -0.14 0 C-N-CA 124.65 1.18 . . . . 0.0 110.405 -171.273 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -38.03 -58.18 0.97 Allowed 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.648 1.179 . . . . 0.0 113.548 -171.762 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -64.21 -38.36 90.78 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 122.751 0.42 . . . . 0.0 111.196 -175.071 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.556 ' H ' ' CD1' ' A' ' 53' ' ' ILE . 0.8 OUTLIER -62.13 -54.12 38.61 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 N-CA-C 106.397 -1.705 . . . . 0.0 106.397 179.206 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 87.5 t -57.4 -42.09 79.88 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 C-N-CA 124.173 0.989 . . . . 0.0 110.566 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.05 -50.59 73.13 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 119.384 0.993 . . . . 0.0 110.886 175.13 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 42.1 mt -54.21 -45.19 72.18 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 119.396 -0.335 . . . . 0.0 110.681 177.168 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 23.2 mmt -64.94 -60.69 2.77 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 121.403 0.621 . . . . 0.0 109.499 177.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -42.7 -42.93 3.68 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 126.815 2.046 . . . . 0.0 111.521 -178.4 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -45.7 -45.37 14.22 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 118.517 -0.754 . . . . 0.0 112.97 178.19 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . 0.259 0.5 OUTLIER -72.04 -11.49 60.78 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 119.805 1.184 . . . . 0.0 113.209 -176.838 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -90.68 -53.89 4.22 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 118.983 0.81 . . . . 0.0 109.206 169.774 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 55.3 ttm-85 -55.23 -31.89 61.84 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.986 0.914 . . . . 0.0 110.693 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 70.4 m-80 -134.87 77.62 1.69 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 126.519 1.928 . . . . 0.0 109.244 175.433 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 43.0 mttp -70.63 -57.86 4.27 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 105.233 -2.136 . . . . 0.0 105.233 168.55 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -149.62 58.68 1.0 Allowed 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 126.886 2.074 . . . . 0.0 105.635 168.447 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -122.05 165.78 15.52 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 170.357 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.9 mp0 -115.89 132.51 56.62 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 106.241 -1.763 . . . . 0.0 106.241 169.658 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -96.96 151.16 4.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 C-N-CA 124.266 1.026 . . . . 0.0 108.467 172.442 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -92.94 177.12 6.18 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 122.834 0.454 . . . . 0.0 111.287 176.755 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 79.6 t80 -41.14 -62.43 0.84 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.315 1.046 . . . . 0.0 112.034 171.32 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 39.8 tp60 -60.64 -37.42 81.43 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 119.24 0.927 . . . . 0.0 111.623 -174.809 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -61.47 -44.68 96.67 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 119.28 0.946 . . . . 0.0 111.424 173.029 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -53.94 -50.03 67.38 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 118.742 0.701 . . . . 0.0 109.726 172.581 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.401 ' CG2' ' CG2' ' B' ' 74' ' ' ILE . 28.1 mm -57.96 -38.27 65.7 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 O-C-N 121.901 -0.499 . . . . 0.0 110.518 176.024 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 61.3 m -64.88 -42.39 94.85 Favored 'General case' 0 C--O 1.226 -0.134 0 CA-C-N 118.824 0.738 . . . . 0.0 110.234 177.781 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.4 ' CE2' HD12 ' A' ' 34' ' ' LEU . 33.0 t80 -55.55 -52.69 62.88 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.429 0.691 . . . . 0.0 109.213 174.863 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 62.3 mt -60.66 -44.69 96.14 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 177.31 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.13 -44.41 94.12 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 110.623 -0.991 . . . . 0.0 110.623 -176.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.85 -52.13 66.74 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.252 0.621 . . . . 0.0 109.824 174.718 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 11.7 tp -47.78 -58.15 4.7 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 122.002 0.906 . . . . 0.0 110.381 175.228 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -49.67 -55.47 13.65 Favored 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 125.43 1.492 . . . . 0.0 109.857 -179.327 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 12.9 ttp -60.53 -44.31 96.19 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 123.364 0.666 . . . . 0.0 111.507 -178.738 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 51.7 mt -59.19 -54.61 31.9 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-O 118.258 -0.877 . . . . 0.0 110.049 -178.36 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.391 0.6 OUTLIER -76.0 -34.22 59.71 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 118.188 -1.405 . . . . 0.0 112.964 -179.08 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 37.0 m-80 -80.33 71.06 7.11 Favored 'General case' 0 N--CA 1.465 0.276 0 O-C-N 120.654 -1.279 . . . . 0.0 108.747 170.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -46.55 -31.5 2.82 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.554 1.142 . . . . 0.0 112.798 -178.124 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -42.47 -37.75 1.71 Allowed 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.044 1.338 . . . . 0.0 113.729 173.264 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 88.4 mt -81.21 -13.65 58.34 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 112.949 0.722 . . . . 0.0 112.949 -177.61 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 48.0 mtpt -82.22 57.95 3.81 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 119.292 0.951 . . . . 0.0 110.392 -170.79 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.295 0 CA-C-O 118.209 -1.328 . . . . 0.0 113.021 -174.683 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 35.4 tpp . . . . . 0 N--CA 1.476 0.853 0 CA-C-O 121.776 0.798 . . . . 0.0 109.963 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -78.73 68.11 4.62 Favored 'General case' 0 N--CA 1.454 -0.249 0 O-C-N 121.852 -0.53 . . . . 0.0 109.764 178.735 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 9.6 m -54.14 160.57 2.31 Favored Pre-proline 0 CA--C 1.538 0.509 0 C-N-CA 123.309 0.643 . . . . 0.0 110.851 175.172 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_exo -42.16 -49.56 5.86 Favored 'Trans proline' 0 N--CA 1.459 -0.52 0 C-N-CA 123.775 2.983 . . . . 0.0 113.661 177.275 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 6.1 mt -54.52 -50.52 67.67 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-N 117.956 0.344 . . . . 0.0 111.54 173.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -63.49 -40.9 98.31 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 118.211 0.459 . . . . 0.0 110.196 -175.126 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 tp60 -61.89 -47.07 86.64 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 122.142 0.177 . . . . 0.0 110.694 174.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.05 -46.88 85.45 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.465 0.706 . . . . 0.0 111.02 -178.428 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 62.1 mt -51.4 -54.4 11.91 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 N-CA-C 107.948 -1.131 . . . . 0.0 107.948 169.687 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.07 -46.88 20.57 Favored Glycine 0 CA--C 1.528 0.859 0 C-N-CA 124.906 1.241 . . . . 0.0 112.183 175.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.2 mt -57.38 -54.21 49.37 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 117.59 0.695 . . . . 0.0 111.055 174.489 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -58.52 -44.07 89.37 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 118.863 0.756 . . . . 0.0 111.481 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 72.2 mt -54.38 -55.73 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 C-N-CA 123.462 0.705 . . . . 0.0 110.077 172.496 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.28 -51.38 51.36 Favored Glycine 0 CA--C 1.524 0.633 0 N-CA-C 110.234 -1.146 . . . . 0.0 110.234 -176.781 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 14.1 mm -54.5 -45.83 70.84 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 C-N-CA 122.79 0.436 . . . . 0.0 110.499 175.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -57.12 -60.19 3.98 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 118.465 0.575 . . . . 0.0 109.997 176.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -55.34 -36.46 66.31 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 124.424 1.09 . . . . 0.0 111.511 -174.181 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -52.59 -31.06 34.4 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.566 1.146 . . . . 0.0 112.257 176.714 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -112.59 -34.08 5.94 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.764 0.711 . . . . 0.0 112.076 -179.315 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 77.8 p -74.42 -35.54 63.4 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 119.135 0.88 . . . . 0.0 110.866 179.582 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -72.45 61.76 1.5 Allowed Glycine 0 C--N 1.341 0.815 0 C-N-CA 125.181 1.372 . . . . 0.0 111.032 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -144.45 -53.28 0.32 Allowed 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 127.22 2.208 . . . . 0.0 106.715 -177.477 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -78.22 164.83 24.58 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 169.328 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -61.26 -54.31 37.38 Favored Glycine 0 CA--C 1.528 0.885 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 177.63 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -79.45 67.74 5.28 Favored 'General case' 0 CA--C 1.531 0.217 0 O-C-N 122.124 -0.633 . . . . 0.0 109.776 -177.616 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -68.79 5.2 1.16 Allowed 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 114.262 1.208 . . . . 0.0 114.262 -176.118 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -78.34 -11.54 59.95 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 166.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 22.9 p -129.87 164.25 24.56 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 124.836 1.255 . . . . 0.0 111.419 -177.755 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -159.56 169.07 24.62 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.626 1.17 . . . . 0.0 109.364 169.716 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 78.5 p -115.94 174.16 6.18 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 -169.382 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 38.1 mtmm -26.35 -60.3 0.08 Allowed 'General case' 0 C--N 1.34 0.171 0 C-N-CA 127.764 2.426 . . . . 0.0 112.597 169.7 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 28.8 ttpp -53.37 -53.23 54.18 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.885 0.874 . . . . 0.0 110.748 -177.091 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -61.36 -40.44 94.31 Favored 'General case' 0 C--O 1.222 -0.344 0 CA-C-O 118.967 -0.54 . . . . 0.0 110.595 179.293 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 31.1 mt -64.49 -48.05 76.65 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.934 0.788 . . . . 0.0 111.179 -179.52 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -58.12 -47.93 81.77 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 176.028 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.63 -51.14 69.85 Favored 'General case' 0 C--O 1.225 -0.216 0 CA-C-N 117.762 0.255 . . . . 0.0 111.242 174.976 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 11.5 mt -48.18 -57.51 5.8 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 124.25 1.02 . . . . 0.0 109.77 179.07 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 1.3 mp -56.84 -59.1 3.42 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 C-N-CA 120.18 -0.608 . . . . 0.0 109.831 175.179 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -51.33 -46.8 62.75 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.358 0.663 . . . . 0.0 112.372 -171.183 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.71 -64.54 1.16 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.709 0.804 . . . . 0.0 110.08 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -73.87 -24.84 59.8 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -167.177 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 96.3 mt -124.24 64.89 1.07 Allowed 'General case' 0 C--N 1.333 -0.12 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 169.287 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 5.1 t -69.24 53.3 0.1 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.176 1.391 . . . . 0.0 111.123 173.875 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 63.0 mt -78.68 76.74 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.659 0 N-CA-C 106.707 -1.59 . . . . 0.0 106.707 -178.353 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -48.49 -50.46 24.33 Favored Glycine 0 CA--C 1.529 0.95 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 176.047 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 6.4 m -70.96 67.43 0.41 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.282 1.033 . . . . 0.0 110.214 170.748 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 47' ' ' LYS . . . . . 0.449 ' HB3' HD11 ' B' ' 53' ' ' ILE . 27.0 mmtm -44.48 92.86 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 126.78 2.032 . . . . 0.0 112.306 -174.607 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 98.2 mt -58.47 112.85 1.73 Allowed 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 124.131 0.972 . . . . 0.0 112.51 -172.375 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 63.94 -79.2 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 125.387 1.475 . . . . 0.0 113.773 167.066 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -169.76 -41.65 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 118.279 0.491 . . . . 0.0 111.927 -167.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -34.77 -60.99 0.42 Allowed 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.905 1.282 . . . . 0.0 113.72 -176.614 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -66.23 -33.97 76.96 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.588 0.355 . . . . 0.0 111.365 -174.469 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 53' ' ' ILE . . . . . 0.463 ' H ' ' CD1' ' B' ' 53' ' ' ILE . 1.0 OUTLIER -62.89 -55.73 21.87 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 178.665 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 55.8 t -57.66 -43.82 84.3 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 CA-C-O 118.755 -0.64 . . . . 0.0 110.599 179.6 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.48 -51.06 69.87 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 119.233 0.924 . . . . 0.0 110.562 176.492 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 55.2 mt -56.63 -40.58 75.63 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 119.058 -0.496 . . . . 0.0 111.405 178.751 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 28.3 mmt -67.25 -65.04 0.74 Allowed 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.919 0.781 . . . . 0.0 109.453 175.531 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -40.58 -41.93 1.57 Allowed 'General case' 0 CA--C 1.521 -0.155 0 C-N-CA 128.022 2.529 . . . . 0.0 111.939 -177.693 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -37.73 -49.17 1.13 Allowed 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 124.93 1.292 . . . . 0.0 112.287 176.904 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.6 pp -61.18 -42.91 99.41 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 120.958 -0.297 . . . . 0.0 111.085 -176.613 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -73.98 -38.3 64.19 Favored 'General case' 0 C--O 1.226 -0.173 0 C-N-CA 123.155 0.582 . . . . 0.0 110.407 -179.175 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 15.8 ttm180 -59.46 -47.98 83.39 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.164 0.586 . . . . 0.0 109.951 177.788 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -79.71 -48.8 13.06 Favored 'General case' 0 N--CA 1.457 -0.094 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.264 -175.52 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 54.5 mttp 57.64 -97.37 0.07 Allowed 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 -166.503 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -135.47 34.26 2.99 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.871 0.868 . . . . 0.0 110.03 172.793 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -123.61 143.69 50.07 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 124.581 1.152 . . . . 0.0 109.027 176.405 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 40.6 mp0 -71.59 135.87 47.16 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 171.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 11.7 m -80.07 145.25 9.46 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 171.478 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -82.89 172.21 13.06 Favored 'General case' 0 CA--C 1.528 0.107 0 CA-C-N 117.961 0.346 . . . . 0.0 111.193 176.282 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -40.86 -61.61 0.94 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.185 0.994 . . . . 0.0 112.146 172.161 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 38.2 tp60 -60.33 -37.04 79.36 Favored 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.224 -0.922 . . . . 0.0 111.795 -175.692 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -64.93 -40.82 95.62 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 121.284 -0.885 . . . . 0.0 111.488 174.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -56.43 -49.72 73.74 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.571 -0.706 . . . . 0.0 109.622 170.535 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 0.401 ' CG2' ' CG2' ' A' ' 74' ' ' ILE . 29.0 mm -56.24 -39.56 60.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 175.884 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 43.1 m -65.69 -35.74 81.63 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 118.59 0.632 . . . . 0.0 110.679 176.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 13.1 t80 -56.02 -56.25 23.06 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 171.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 67.7 mt -61.25 -40.13 92.91 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 179.089 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -69.05 -45.6 61.92 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 110.675 -0.97 . . . . 0.0 110.675 -176.134 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.29 -43.82 89.92 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 122.112 -0.64 . . . . 0.0 110.058 175.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 12.0 tp -50.56 -57.58 7.82 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-O 121.371 0.605 . . . . 0.0 109.939 172.55 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.19 -50.86 48.04 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 124.441 1.096 . . . . 0.0 110.527 176.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 49.2 ttm -58.33 -47.75 82.74 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.715 0.806 . . . . 0.0 111.135 -178.561 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 93.9 mt -64.65 -52.72 51.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 CA-C-O 118.135 -0.936 . . . . 0.0 110.398 -176.789 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.449 0.1 OUTLIER -76.2 -38.86 55.96 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 118.521 -1.271 . . . . 0.0 113.3 -176.672 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -82.13 66.99 7.96 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 169.87 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -39.44 -37.8 0.5 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.818 1.647 . . . . 0.0 113.842 -175.188 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.99 -53.98 0.47 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.004 1.722 . . . . 0.0 112.502 169.719 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 93.2 mt -63.25 -14.41 49.07 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 123.81 0.844 . . . . 0.0 113.081 -174.039 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -64.89 -33.28 75.65 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 119.894 1.225 . . . . 0.0 110.391 172.276 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.125 0 CA-C-O 117.318 -1.823 . . . . 0.0 110.622 -175.818 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 72.7 mtp . . . . . 0 N--CA 1.474 0.741 0 N-CA-C 109.824 -0.435 . . . . 0.0 109.824 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.85 67.36 3.7 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 171.192 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.1 m -55.56 163.09 2.04 Favored Pre-proline 0 CA--C 1.537 0.452 0 C-N-CA 124.102 0.961 . . . . 0.0 110.846 178.622 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -43.85 -49.02 8.57 Favored 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 123.62 2.88 . . . . 0.0 113.409 179.616 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.2 mt -55.14 -52.13 64.25 Favored 'General case' 0 C--O 1.225 -0.218 0 O-C-N 122.369 -0.207 . . . . 0.0 111.512 174.346 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -61.56 -41.98 98.18 Favored 'General case' 0 C--O 1.226 -0.181 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 -175.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 12.6 tp-100 -60.31 -51.25 70.33 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 123.4 0.68 . . . . 0.0 110.203 177.157 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.14 -46.15 88.58 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.291 0.636 . . . . 0.0 111.442 -177.921 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 56.4 mt -53.07 -51.43 38.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 170.4 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -48.61 -48.03 29.18 Favored Glycine 0 CA--C 1.525 0.688 0 C-N-CA 125.14 1.352 . . . . 0.0 111.587 175.649 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 mt -56.54 -54.03 50.6 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 117.652 0.726 . . . . 0.0 111.055 174.258 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 mp -58.81 -43.71 90.64 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 119.032 0.833 . . . . 0.0 111.453 -179.404 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 94.2 mt -56.52 -51.66 62.58 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 C-N-CA 123.632 0.773 . . . . 0.0 110.36 172.641 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.23 -51.58 53.19 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.046 -1.222 . . . . 0.0 110.046 -178.224 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 10.4 mm -57.01 -46.29 84.08 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 123.158 0.583 . . . . 0.0 110.284 176.893 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 40.6 t80 -53.2 -59.16 4.9 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 121.211 0.529 . . . . 0.0 109.965 176.754 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 67.4 t60 -62.09 -33.75 75.02 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.706 -175.682 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -51.96 -45.61 64.46 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.69 0.677 . . . . 0.0 110.963 176.38 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -89.86 -49.55 6.56 Favored 'General case' 0 N--CA 1.46 0.037 0 CA-C-O 118.932 -0.556 . . . . 0.0 110.946 -178.67 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 74.8 m -49.55 -36.33 23.29 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-N 119.166 0.894 . . . . 0.0 111.384 174.652 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -30.75 -42.66 0.07 OUTLIER Glycine 0 CA--C 1.527 0.785 0 C-N-CA 127.369 2.414 . . . . 0.0 114.691 172.555 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 14.3 ptpt -80.73 -15.67 55.89 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 -173.599 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -101.51 126.4 48.31 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 125.052 1.341 . . . . 0.0 107.506 177.604 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -41.88 -38.66 2.5 Favored Glycine 0 CA--C 1.535 1.32 0 C-N-CA 124.562 1.077 . . . . 0.0 113.945 -175.706 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -77.58 69.17 3.79 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.508 1.123 . . . . 0.0 108.728 170.016 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 48.0 mtmt -72.18 31.95 0.06 Allowed 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 116.038 1.866 . . . . 0.0 116.038 -168.056 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 4.7 p80 -150.36 43.95 0.86 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.884 1.274 . . . . 0.0 109.149 168.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -161.25 155.12 22.23 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 103.192 -2.892 . . . . 0.0 103.192 178.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -160.74 168.04 25.62 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 120.158 1.345 . . . . 0.0 112.253 177.555 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 24.7 p -113.19 176.46 5.01 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.617 0.723 . . . . 0.0 112.503 -173.42 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 20.7 pttm -40.62 -46.94 2.66 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 126.051 1.74 . . . . 0.0 112.846 174.802 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.0 tmmt? -59.08 -49.7 76.89 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -178.083 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 27.2 mp0 -62.98 -38.62 91.88 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 118.756 -0.64 . . . . 0.0 110.963 177.684 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 26.1 mt -62.43 -45.01 95.05 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 119.319 0.963 . . . . 0.0 111.182 178.418 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -58.3 -49.47 77.03 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 122.025 -0.422 . . . . 0.0 109.978 173.203 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 57.6 mt-10 -56.47 -43.82 79.97 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 118.03 0.377 . . . . 0.0 111.449 175.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.0 mt -54.32 -56.3 19.84 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 119.296 0.953 . . . . 0.0 109.492 -178.432 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 1.3 mp -55.96 -60.7 1.55 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 175.409 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.8 tt0 -52.31 -51.42 58.74 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.649 0.78 . . . . 0.0 112.383 -171.703 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.1 mmpt? -73.4 -61.12 1.94 Allowed 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.987 1.315 . . . . 0.0 109.307 -175.343 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 60.5 mm-40 -76.71 -58.01 3.53 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -169.896 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 85.1 mt -87.01 61.86 7.04 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 178.868 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.5 t -73.12 56.56 0.45 Allowed 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.704 1.202 . . . . 0.0 109.712 173.632 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 72.2 mt -68.39 -45.83 81.67 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 C-N-CA 125.764 1.626 . . . . 0.0 109.057 -175.346 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.59 -68.83 1.21 Allowed Glycine 0 CA--C 1.528 0.864 0 N-CA-C 110.522 -1.031 . . . . 0.0 110.522 -178.754 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.8 m -71.28 71.14 0.61 Allowed 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.286 1.034 . . . . 0.0 109.292 170.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 60.8 mmtt -46.8 95.45 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.918 1.687 . . . . 0.0 111.18 -175.413 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 73.5 mt -35.89 -54.62 0.75 Allowed 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 126.581 1.952 . . . . 0.0 113.495 -171.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -163.2 161.97 25.2 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 -174.701 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -35.47 -41.01 0.17 Allowed 'General case' 0 N--CA 1.462 0.153 0 C-N-CA 128.226 2.61 . . . . 0.0 114.513 -172.508 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.46 -58.27 0.16 Allowed 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 126.08 1.752 . . . . 0.0 113.839 -177.408 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -70.08 -35.88 74.51 Favored 'General case' 0 CA--C 1.53 0.191 0 O-C-N 122.258 -0.276 . . . . 0.0 111.466 -173.23 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.491 HD12 ' H ' ' A' ' 53' ' ' ILE . 1.2 mp -62.72 -54.71 30.27 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 177.064 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 72.5 t -54.21 -44.45 64.67 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 C-N-CA 124.458 1.103 . . . . 0.0 110.034 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 2.9 mptp? -57.52 -53.17 61.23 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 118.283 0.492 . . . . 0.0 110.793 175.337 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 71.2 mt -54.83 -37.81 66.61 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 118.965 -0.54 . . . . 0.0 111.198 178.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 27.8 mmt -66.95 -67.61 0.44 Allowed 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 118.809 0.732 . . . . 0.0 109.525 173.79 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -40.48 -42.62 1.66 Allowed 'General case' 0 C--N 1.341 0.199 0 C-N-CA 127.527 2.331 . . . . 0.0 111.95 -176.563 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -38.7 -49.64 1.59 Allowed 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 125.261 1.424 . . . . 0.0 112.492 177.095 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -63.24 -42.0 99.14 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 121.032 -0.267 . . . . 0.0 110.715 -176.87 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -69.52 -42.17 75.04 Favored 'General case' 0 N--CA 1.457 -0.084 0 C-N-CA 123.538 0.735 . . . . 0.0 109.602 -178.772 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 17.5 ttm180 -58.17 -51.45 69.7 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 124.25 1.02 . . . . 0.0 110.143 178.647 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -82.47 -46.57 13.28 Favored 'General case' 0 CA--C 1.522 -0.099 0 N-CA-C 111.597 0.221 . . . . 0.0 111.597 -172.051 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 56.8 mttp 59.35 -87.58 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.49 1.116 . . . . 0.0 108.866 -168.135 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 25.8 m-20 -148.35 38.01 0.86 Allowed 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.996 1.319 . . . . 0.0 109.644 171.541 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -126.26 145.95 50.2 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 125.179 1.392 . . . . 0.0 107.739 175.867 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 22.5 mp0 -67.05 164.75 17.16 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 169.286 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 25.8 m -115.05 149.11 17.36 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.558 0 C-N-CA 125.917 1.687 . . . . 0.0 107.758 169.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -85.8 175.57 8.6 Favored 'General case' 0 C--N 1.338 0.102 0 C-N-CA 123.68 0.792 . . . . 0.0 111.015 177.454 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -41.91 -63.8 0.68 Allowed 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.806 1.242 . . . . 0.0 112.436 175.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 9.9 tp-100 -64.5 -30.45 71.48 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 120.339 1.427 . . . . 0.0 112.019 -173.276 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -66.84 -45.53 77.94 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 119.35 0.977 . . . . 0.0 110.348 175.17 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -54.72 -52.27 62.99 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 172.714 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 22.8 mm -55.32 -41.41 61.58 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.411 0 C-N-CA 123.102 0.561 . . . . 0.0 109.519 176.88 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 99.4 m -62.39 -36.04 81.08 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-N 119.089 0.859 . . . . 0.0 111.062 177.088 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -54.89 -54.57 40.8 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 118.887 0.767 . . . . 0.0 109.185 171.35 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 62.3 mt -63.63 -40.86 97.97 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 -179.506 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -72.83 -44.29 38.58 Favored Glycine 0 CA--C 1.522 0.522 0 N-CA-C 110.128 -1.189 . . . . 0.0 110.128 -174.365 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.43 -45.11 92.44 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 121.949 -0.736 . . . . 0.0 109.795 173.255 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 12.4 tp -49.81 -58.14 5.96 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 118.802 0.728 . . . . 0.0 109.909 173.133 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -49.34 -54.03 19.19 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 124.804 1.242 . . . . 0.0 110.606 178.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 25.4 ttp -64.11 -41.54 97.21 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.252 0.621 . . . . 0.0 112.068 -176.443 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 80.0 mt -65.12 -51.56 64.29 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 CA-C-O 118.042 -0.98 . . . . 0.0 109.746 -178.879 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.46 0.1 OUTLIER -75.76 -39.3 57.34 Favored 'General case' 0 C--N 1.346 0.436 0 CA-C-N 119.713 1.142 . . . . 0.0 113.283 -178.544 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 -81.07 65.01 6.05 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 168.861 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -47.91 -32.86 6.8 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.94 1.296 . . . . 0.0 112.4 -169.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -32.54 -50.55 0.25 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 126.104 1.762 . . . . 0.0 112.773 168.355 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 63.2 mt -61.53 -20.08 62.84 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.015 0.926 . . . . 0.0 113.322 -174.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -65.82 -26.22 67.57 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 119.512 1.051 . . . . 0.0 110.999 173.443 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.185 0 CA-C-O 117.279 -1.845 . . . . 0.0 111.498 -176.516 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 92.5 mmm . . . . . 0 N--CA 1.476 0.835 0 N-CA-C 110.491 -0.189 . . . . 0.0 110.491 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -79.25 63.83 3.99 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 121.191 0.519 . . . . 0.0 110.053 177.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 4.2 m -58.1 165.17 2.84 Favored Pre-proline 0 CA--C 1.538 0.513 0 C-N-CA 124.961 1.305 . . . . 0.0 111.365 179.193 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -44.47 -46.77 11.71 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 123.503 2.802 . . . . 0.0 113.306 177.834 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.426 HD23 ' HA ' ' B' ' 5' ' ' LEU . 5.7 mt -56.16 -51.48 67.82 Favored 'General case' 0 C--O 1.225 -0.229 0 CA-C-N 117.844 0.293 . . . . 0.0 111.577 174.123 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -57.83 -45.57 85.97 Favored 'General case' 0 N--CA 1.456 -0.159 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 -177.782 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -58.73 -51.57 69.41 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 122.932 0.493 . . . . 0.0 110.727 177.38 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.32 -45.41 88.0 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.719 0.807 . . . . 0.0 111.668 -176.158 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 78.7 mt -54.13 -52.38 38.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 170.475 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.15 -48.36 15.08 Favored Glycine 0 CA--C 1.528 0.855 0 C-N-CA 124.867 1.222 . . . . 0.0 111.946 174.539 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.3 mt -56.88 -55.85 29.15 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 117.649 0.725 . . . . 0.0 111.27 174.407 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -58.69 -42.38 88.42 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.172 0.897 . . . . 0.0 111.711 -178.445 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 78.7 mt -54.63 -58.97 2.64 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.135 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 171.442 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -52.29 -48.03 54.69 Favored Glycine 0 CA--C 1.524 0.604 0 C-N-CA 124.726 1.155 . . . . 0.0 111.214 -175.852 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 12.5 mm -54.63 -46.58 72.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 C-N-CA 123.105 0.562 . . . . 0.0 110.386 176.395 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 26.2 t80 -61.05 -54.27 46.88 Favored 'General case' 0 CA--C 1.531 0.241 0 O-C-N 121.708 -0.62 . . . . 0.0 109.818 176.1 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -50.74 -41.72 56.81 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 125.308 1.443 . . . . 0.0 111.435 -176.863 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -55.58 -34.01 64.41 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.934 1.293 . . . . 0.0 112.407 179.312 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 47.1 m-85 -109.06 -57.45 2.15 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 123.587 0.755 . . . . 0.0 110.896 -176.429 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -73.93 -48.71 28.71 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.504 0.722 . . . . 0.0 110.244 -177.983 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.45 64.19 3.25 Favored Glycine 0 C--N 1.336 0.541 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.681 -168.81 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 20.4 mmmt -106.06 -166.27 1.18 Allowed 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 169.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -78.65 65.7 3.97 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.149 0.58 . . . . 0.0 109.742 -179.446 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -165.63 -145.37 4.4 Favored Glycine 0 CA--C 1.527 0.828 0 N-CA-C 110.32 -1.112 . . . . 0.0 110.32 -177.444 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -78.75 62.63 3.31 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.591 1.156 . . . . 0.0 110.568 -174.118 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.79 -20.97 2.46 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 116.475 2.028 . . . . 0.0 116.475 -169.497 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 21.9 t-160 -78.51 -19.57 52.68 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.493 1.117 . . . . 0.0 111.552 179.607 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 1.1 p -130.57 158.68 39.33 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 125.107 1.363 . . . . 0.0 112.606 -168.452 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.94 -179.79 7.84 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.055 1.342 . . . . 0.0 108.553 169.423 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 7.3 t -141.6 -163.21 1.52 Allowed 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 119.355 0.98 . . . . 0.0 112.673 -178.127 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 8.6 mtpm? -36.79 -69.12 0.12 Allowed 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 128.716 2.806 . . . . 0.0 113.662 -169.189 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -55.38 -46.97 76.5 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 122.772 0.429 . . . . 0.0 110.068 -173.625 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -61.32 -44.12 97.74 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 123.797 0.839 . . . . 0.0 110.712 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 51.7 mt -61.31 -52.98 62.43 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 118.341 0.519 . . . . 0.0 111.015 177.072 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 47.9 mtpt -60.92 -42.61 98.46 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -177.786 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 66.4 mt-10 -54.61 -55.58 28.02 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-O 118.962 -0.542 . . . . 0.0 110.904 169.839 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 9.1 mt -47.36 -58.89 3.63 Favored 'General case' 0 N--CA 1.457 -0.103 0 C-N-CA 123.406 0.682 . . . . 0.0 110.193 -178.482 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 13.3 tt -59.34 -55.18 25.39 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 C-N-CA 119.766 -0.774 . . . . 0.0 110.54 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -58.41 -46.05 87.18 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 118.435 0.562 . . . . 0.0 112.438 -172.7 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -76.76 -51.08 12.07 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.509 0.724 . . . . 0.0 110.093 -177.263 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -83.54 -28.7 28.43 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -168.247 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 32.7 mt -96.27 86.96 4.35 Favored 'General case' 0 C--N 1.338 0.069 0 N-CA-C 106.412 -1.699 . . . . 0.0 106.412 168.483 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 72.3 p -77.3 56.65 1.36 Allowed 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 124.848 1.259 . . . . 0.0 109.063 -178.491 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 36.3 mt -75.02 -58.84 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.605 0 C-N-CA 124.395 1.078 . . . . 0.0 108.426 -174.282 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 68.61 -71.68 0.37 Allowed Glycine 0 CA--C 1.529 0.942 0 N-CA-C 110.092 -1.203 . . . . 0.0 110.092 -174.655 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 19.3 m -63.6 80.27 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 125.629 1.572 . . . . 0.0 110.146 172.404 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 11.6 mmtm -39.96 91.52 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 127.358 2.263 . . . . 0.0 112.2 178.096 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 89.3 mt -52.68 -54.15 37.42 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 124.569 1.148 . . . . 0.0 111.921 -173.105 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -164.77 160.61 19.84 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 -174.468 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -38.12 -42.06 0.63 Allowed 'General case' 0 C--O 1.227 -0.113 0 C-N-CA 127.474 2.31 . . . . 0.0 114.397 -171.474 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.58 -61.57 0.14 Allowed 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 125.594 1.558 . . . . 0.0 114.146 -175.217 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -60.31 -43.15 96.62 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.298 0.639 . . . . 0.0 111.333 -175.812 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 53' ' ' ILE . . . . . 0.526 ' H ' ' CD1' ' B' ' 53' ' ' ILE . 1.0 OUTLIER -62.16 -51.99 65.79 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 N-CA-C 106.066 -1.827 . . . . 0.0 106.066 -178.785 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 70.7 t -55.3 -40.02 54.74 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.613 0 CA-C-N 114.891 -1.05 . . . . 0.0 110.239 178.378 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.84 -52.81 63.48 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 120.214 1.37 . . . . 0.0 110.517 174.741 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 57.1 mt -53.52 -39.57 64.74 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 119.573 -0.251 . . . . 0.0 110.683 -178.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 22.9 mmt -71.12 -64.23 0.95 Allowed 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.424 0.63 . . . . 0.0 110.003 175.54 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.01 -29.4 60.29 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 125.041 1.336 . . . . 0.0 112.212 -169.718 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -39.52 -50.69 2.19 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 124.632 1.173 . . . . 0.0 111.037 170.584 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 54.1 mt -58.82 -47.08 86.07 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.125 -176.421 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -69.73 -46.43 65.93 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.439 0.696 . . . . 0.0 111.283 -178.128 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 50.9 ttt85 -56.84 -52.22 65.94 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 124.972 1.309 . . . . 0.0 109.414 -179.774 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -78.87 -56.8 4.12 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 116.625 -0.261 . . . . 0.0 111.556 -176.121 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 45.1 mttm 64.82 -78.01 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.738 1.215 . . . . 0.0 109.041 -167.531 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -147.57 20.54 1.18 Allowed 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 125.572 1.549 . . . . 0.0 110.49 171.637 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -97.19 144.34 27.11 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 124.188 0.995 . . . . 0.0 108.82 -177.836 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -82.12 142.25 32.41 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 167.271 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 20.9 m -99.89 146.49 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 169.837 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -85.36 176.02 8.54 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 123.418 0.687 . . . . 0.0 111.271 175.885 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -40.65 -63.82 0.6 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.306 1.043 . . . . 0.0 112.533 172.421 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 61.6 tp60 -61.03 -36.21 78.92 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 119.755 1.161 . . . . 0.0 111.671 -175.425 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -64.37 -35.84 82.18 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.255 -0.903 . . . . 0.0 111.081 175.621 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -62.97 -46.8 86.02 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.507 -0.746 . . . . 0.0 109.626 169.361 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 24.2 mm -60.63 -29.19 44.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 O-C-N 121.49 -0.756 . . . . 0.0 110.513 176.187 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 25.3 m -67.2 -45.13 77.8 Favored 'General case' 0 C--O 1.227 -0.1 0 O-C-N 121.232 -0.917 . . . . 0.0 109.411 171.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -52.32 -54.99 24.51 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 173.676 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 38.8 mt -59.44 -46.36 88.98 Favored 'General case' 0 CA--C 1.529 0.168 0 O-C-N 121.727 -0.608 . . . . 0.0 111.691 177.86 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.57 -45.68 92.91 Favored Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 -179.261 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.97 -51.74 65.71 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 123.493 0.717 . . . . 0.0 110.023 177.281 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -47.36 -58.68 3.87 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.95 0.881 . . . . 0.0 110.272 174.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.08 -56.61 11.73 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 125.18 1.392 . . . . 0.0 110.643 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 12.8 ttp -67.05 -39.15 86.84 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.607 0.763 . . . . 0.0 111.806 -174.372 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 64.5 mt -63.74 -51.76 65.75 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 CA-C-O 117.807 -1.092 . . . . 0.0 109.195 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.474 0.3 OUTLIER -75.25 -38.15 60.67 Favored 'General case' 0 C--N 1.348 0.5 0 CA-C-N 119.897 1.226 . . . . 0.0 113.319 -179.867 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 -80.57 61.88 4.44 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 168.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -52.26 -25.01 8.31 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.532 1.133 . . . . 0.0 112.55 -175.818 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -38.6 -46.72 1.23 Allowed 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.164 1.385 . . . . 0.0 111.845 167.366 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 84.4 mt -66.85 -25.03 66.23 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.12 0.968 . . . . 0.0 113.041 -178.218 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt -80.15 -44.42 19.91 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 171.146 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.13 0 CA-C-O 117.427 -1.763 . . . . 0.0 110.386 174.116 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 ppp? . . . . . 0 N--CA 1.477 0.903 0 N-CA-C 113.072 0.767 . . . . 0.0 113.072 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -71.83 80.7 0.88 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.99 0.916 . . . . 0.0 111.431 -173.617 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 78.7 p -60.69 167.4 3.4 Favored Pre-proline 0 CA--C 1.536 0.418 0 C-N-CA 124.414 1.086 . . . . 0.0 112.2 175.479 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -50.57 -44.3 40.84 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 122.619 2.213 . . . . 0.0 111.215 168.245 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.415 HD23 ' HA ' ' A' ' 5' ' ' LEU . 4.8 mt -53.65 -57.49 10.61 Favored 'General case' 0 C--N 1.342 0.252 0 CA-C-O 119.448 -0.31 . . . . 0.0 111.671 170.871 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -52.57 -47.65 66.68 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 120.848 0.356 . . . . 0.0 110.356 -177.757 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 -59.39 -49.41 77.92 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.921 0.888 . . . . 0.0 110.919 178.351 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.77 -46.63 88.74 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.866 0.866 . . . . 0.0 111.132 -178.084 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 83.1 mt -54.67 -51.41 51.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 172.057 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.72 -50.35 14.78 Favored Glycine 0 CA--C 1.53 0.991 0 C-N-CA 124.562 1.077 . . . . 0.0 111.963 173.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 mt -54.65 -54.37 42.52 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 117.721 0.761 . . . . 0.0 110.936 175.297 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 9.8 mp -58.71 -43.68 90.17 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 118.79 0.723 . . . . 0.0 111.687 -178.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 97.3 mt -58.59 -52.18 62.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 C-N-CA 123.22 0.608 . . . . 0.0 110.433 174.789 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.96 -54.55 34.51 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 109.942 -1.263 . . . . 0.0 109.942 -178.325 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 6.0 mm -50.01 -50.11 20.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.25 0 C-N-CA 123.843 0.857 . . . . 0.0 109.911 174.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -52.89 -62.71 1.47 Allowed 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 179.058 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -63.38 -23.57 67.47 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 -175.408 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.8 ttpp -53.94 -24.69 17.28 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 118.782 0.719 . . . . 0.0 111.97 170.502 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -116.95 -37.34 3.61 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.044 0.938 . . . . 0.0 112.792 175.71 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 75.5 p -79.82 -32.01 40.64 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 119.515 1.052 . . . . 0.0 112.164 -178.169 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.1 61.77 3.4 Favored Glycine 0 CA--C 1.527 0.802 0 C-N-CA 124.249 0.928 . . . . 0.0 112.088 -169.905 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 33.1 mtmm -98.21 -82.92 0.42 Allowed 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 124.552 1.141 . . . . 0.0 109.571 -176.449 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -148.65 159.99 43.57 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.704 1.201 . . . . 0.0 108.057 -177.3 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 54.49 -107.43 0.68 Allowed Glycine 0 CA--C 1.529 0.918 0 C-N-CA 123.931 0.777 . . . . 0.0 112.301 174.072 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 40.9 t0 -79.82 61.93 3.9 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 121.876 0.846 . . . . 0.0 110.25 -174.528 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 6.0 mtmp? -59.96 -16.73 32.47 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.064 1.346 . . . . 0.0 113.454 -172.64 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 6.5 p-80 -89.46 9.71 25.41 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 175.36 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 74.6 p -123.06 164.63 18.23 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 118.828 0.74 . . . . 0.0 111.318 174.088 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -159.69 -165.04 1.44 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.211 1.404 . . . . 0.0 107.44 169.498 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 9.2 m -156.88 -179.5 8.26 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 119.371 0.987 . . . . 0.0 111.633 -171.753 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -19.72 -72.98 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 129.247 3.019 . . . . 0.0 114.429 176.78 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 39.8 ttpt -53.42 -52.16 60.27 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.515 1.126 . . . . 0.0 109.785 -175.384 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -58.86 -42.84 90.33 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 118.725 -0.655 . . . . 0.0 111.124 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 13.4 mt -61.55 -50.03 74.3 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 119.141 0.882 . . . . 0.0 111.459 176.486 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 62.0 mtpt -58.55 -46.41 86.92 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 122.191 -0.318 . . . . 0.0 110.221 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.81 -51.88 67.24 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 122.856 0.463 . . . . 0.0 110.998 173.773 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.0 mt -46.53 -61.1 1.97 Allowed 'General case' 0 C--N 1.333 -0.151 0 C-N-CA 123.747 0.819 . . . . 0.0 110.561 177.541 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 16.8 tt -59.41 -52.24 63.23 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 C-N-CA 119.829 -0.748 . . . . 0.0 110.157 -178.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -53.99 -50.35 66.79 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 123.604 0.761 . . . . 0.0 112.456 -175.664 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.06 -53.04 7.86 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 123.629 0.771 . . . . 0.0 110.266 -176.77 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 49.2 mm-40 -81.16 -24.38 37.6 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -167.597 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 47.4 mt -105.94 84.01 2.0 Allowed 'General case' 0 CA--C 1.527 0.074 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 169.446 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 52.6 p -75.2 57.41 0.86 Allowed 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 125.479 1.512 . . . . 0.0 109.109 178.174 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 30.0 mt -73.25 -51.75 24.64 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.62 0 C-N-CA 124.073 0.949 . . . . 0.0 108.619 -175.31 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 71.61 -67.72 1.0 Allowed Glycine 0 CA--C 1.528 0.876 0 N-CA-C 110.408 -1.077 . . . . 0.0 110.408 -176.688 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 19.8 m -69.24 74.42 0.34 Allowed 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 125.191 1.397 . . . . 0.0 110.227 174.748 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -32.85 90.94 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 128.011 2.524 . . . . 0.0 112.785 -179.432 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 83.8 mt -65.35 112.43 3.5 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 123.93 0.892 . . . . 0.0 112.34 -169.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 63.48 -77.4 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.553 1.541 . . . . 0.0 113.292 167.16 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -166.58 -46.61 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 123.921 0.888 . . . . 0.0 110.194 -169.237 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -36.4 -62.98 0.42 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.966 1.306 . . . . 0.0 113.415 -175.857 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 73.1 tt0 -59.35 -43.05 92.86 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.85 0.86 . . . . 0.0 111.004 -178.605 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.488 ' H ' ' CD1' ' A' ' 53' ' ' ILE . 0.9 OUTLIER -60.89 -53.72 45.24 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 N-CA-C 106.49 -1.67 . . . . 0.0 106.49 -173.834 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 66.6 t -56.01 -58.68 4.24 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 CA-C-O 118.154 -0.927 . . . . 0.0 108.647 176.256 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -41.22 -51.52 3.51 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 119.038 0.835 . . . . 0.0 112.403 -178.738 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 27.0 mt -55.92 -43.78 77.66 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -176.588 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 1.4 mpp? -82.07 -58.34 3.01 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.958 0.903 . . . . 0.0 109.997 -179.585 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -42.78 -31.29 0.46 Allowed 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 126.671 1.988 . . . . 0.0 111.954 176.364 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -37.2 -43.44 0.51 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.587 1.155 . . . . 0.0 113.261 172.555 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -58.02 -57.58 12.2 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.51 -0.744 . . . . 0.0 110.115 177.789 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -58.61 -45.41 89.25 Favored 'General case' 0 C--O 1.224 -0.289 0 C-N-CA 124.381 1.073 . . . . 0.0 110.361 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 43.0 tpt85 -50.13 -46.0 53.51 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 126.074 1.75 . . . . 0.0 110.785 177.399 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -78.1 -32.93 50.85 Favored 'General case' 0 C--O 1.226 -0.172 0 O-C-N 123.508 0.505 . . . . 0.0 111.403 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 44.5 mmtm 57.79 28.1 15.46 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.528 0.731 . . . . 0.0 109.589 -167.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 52.6 33.97 14.75 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.638 1.175 . . . . 0.0 112.61 -170.126 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -120.47 157.82 28.56 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.895 1.278 . . . . 0.0 108.09 169.403 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -62.1 152.85 31.64 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.277 0.631 . . . . 0.0 110.657 174.854 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -122.35 143.69 34.21 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 C-N-CA 124.898 1.279 . . . . 0.0 108.647 175.246 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 17.4 p30 -92.77 -177.59 4.59 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 125.162 1.385 . . . . 0.0 111.589 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 49.4 t80 -47.37 -60.63 2.38 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.677 0.791 . . . . 0.0 112.769 175.696 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 47.8 tp60 -63.17 -34.63 78.05 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 119.489 1.041 . . . . 0.0 110.579 -175.521 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 72.2 mm-40 -58.26 -49.86 75.61 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.943 -0.473 . . . . 0.0 110.498 173.803 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -55.15 -50.02 70.35 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 122.947 0.499 . . . . 0.0 110.512 173.917 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 26.3 mm -57.26 -34.3 45.52 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 C-N-CA 123.207 0.603 . . . . 0.0 110.534 177.372 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 61.1 m -71.13 -39.29 72.09 Favored 'General case' 0 CA--C 1.531 0.227 0 O-C-N 121.568 -0.708 . . . . 0.0 110.684 176.061 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -57.17 -53.75 54.62 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 118.902 0.774 . . . . 0.0 109.959 173.26 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 53.6 mt -58.57 -42.35 87.77 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.804 0.335 . . . . 0.0 110.854 174.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.42 -46.05 88.09 Favored Glycine 0 CA--C 1.524 0.608 0 C-N-CA 124.244 0.926 . . . . 0.0 111.083 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.3 -49.28 74.63 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.362 0.665 . . . . 0.0 110.001 177.11 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -49.49 -59.63 3.58 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 122.472 1.13 . . . . 0.0 109.879 176.466 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -49.01 -59.75 3.35 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 113.663 -1.608 . . . . 0.0 110.254 178.597 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 22.7 ttp -63.87 -40.27 96.15 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.199 0.6 . . . . 0.0 112.004 -173.644 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 70.0 mt -62.94 -48.94 85.63 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 CA-C-O 117.77 -1.11 . . . . 0.0 109.679 -179.405 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.43 1.2 p90 -79.02 -33.54 44.75 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 117.812 -1.555 . . . . 0.0 113.975 179.117 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 32.1 m-80 -79.98 89.01 5.32 Favored 'General case' 0 C--N 1.334 -0.066 0 O-C-N 121.019 -1.051 . . . . 0.0 109.66 175.698 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -42.04 -42.32 2.84 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.573 0.749 . . . . 0.0 111.082 169.705 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.23 16.77 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 114.854 1.428 . . . . 0.0 114.854 178.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 46.9 mt -130.26 2.91 4.7 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 125.136 1.374 . . . . 0.0 112.533 170.292 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 29.4 mmtp -66.61 85.24 0.11 Allowed 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 119.839 1.199 . . . . 0.0 111.561 -171.879 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.339 0 CA-C-O 117.206 -1.886 . . . . 0.0 109.544 176.434 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.6 ppp? . . . . . 0 N--CA 1.478 0.953 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -80.8 65.74 6.06 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 121.625 -0.672 . . . . 0.0 111.581 -173.17 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.4 m -58.9 167.47 1.92 Allowed Pre-proline 0 CA--C 1.539 0.53 0 C-N-CA 124.688 1.195 . . . . 0.0 111.404 175.525 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_exo -48.27 -47.57 19.41 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 123.234 2.623 . . . . 0.0 112.988 178.091 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.2 mt -57.11 -49.74 74.95 Favored 'General case' 0 C--O 1.224 -0.278 0 C-N-CA 120.672 -0.411 . . . . 0.0 111.391 173.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -59.12 -40.43 85.38 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-N 118.614 0.643 . . . . 0.0 110.276 -177.77 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -63.02 -52.3 63.42 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.405 0.682 . . . . 0.0 110.703 176.859 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.47 -46.3 89.11 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.599 0.76 . . . . 0.0 111.322 -177.788 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 74.2 mt -52.88 -57.45 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 169.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -43.56 -46.41 7.13 Favored Glycine 0 CA--C 1.527 0.819 0 C-N-CA 125.925 1.726 . . . . 0.0 112.456 177.408 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 mt -54.7 -57.12 12.76 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.681 0.792 . . . . 0.0 110.774 172.742 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 11.0 mp -57.62 -42.02 82.47 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.52 -0.737 . . . . 0.0 111.976 178.599 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 18.6 mt -57.36 -56.42 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 C-N-CA 123.828 0.851 . . . . 0.0 110.08 175.326 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.92 -49.79 60.98 Favored Glycine 0 CA--C 1.52 0.404 0 N-CA-C 109.723 -1.351 . . . . 0.0 109.723 -177.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.8 mm -53.84 -46.86 63.99 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 C-N-CA 122.734 0.413 . . . . 0.0 110.558 175.731 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 16' ' ' PHE . . . . . 0.408 ' HB2' ' CE2' ' B' ' 73' ' ' TYR . 42.3 t80 -56.61 -64.2 0.95 Allowed 'General case' 0 N--CA 1.457 -0.114 0 CA-C-N 118.529 0.604 . . . . 0.0 110.004 175.933 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -58.28 -34.96 71.09 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 119.351 -0.356 . . . . 0.0 111.313 -169.774 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 64.8 tttm -50.48 -36.61 34.46 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.7 0.8 . . . . 0.0 112.177 175.514 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 77.3 m-85 -104.29 -41.95 5.63 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.186 0.595 . . . . 0.0 111.4 -178.404 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 96.5 p -70.18 -36.32 74.57 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 121.556 -0.715 . . . . 0.0 111.349 -177.307 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -44.39 -44.18 7.88 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 124.938 1.256 . . . . 0.0 113.482 -173.4 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 6.6 ptpt -77.65 -16.02 58.8 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 113.391 0.886 . . . . 0.0 113.391 -175.163 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 53.7 mm-40 -78.24 37.83 0.27 Allowed 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 119.314 0.961 . . . . 0.0 112.819 -169.736 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 65.12 -75.08 0.08 OUTLIER Glycine 0 CA--C 1.53 0.985 0 C-N-CA 124.395 0.998 . . . . 0.0 111.165 -177.175 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 63.6 t0 -77.89 81.55 4.3 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 171.446 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 39.4 mtmt -36.23 -35.31 0.07 Allowed 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 128.019 2.528 . . . . 0.0 114.508 -177.378 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 16.3 m170 -94.76 17.4 13.62 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.768 0.827 . . . . 0.0 112.202 -172.864 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 51.7 p -141.73 162.04 36.45 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.104 0.961 . . . . 0.0 110.036 177.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -161.21 179.8 8.07 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 118.045 -0.979 . . . . 0.0 108.92 172.329 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.3 t -137.93 -168.04 2.27 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 120.421 1.464 . . . . 0.0 112.254 -178.375 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 14.9 pttp -45.69 -51.41 12.45 Favored 'General case' 0 C--N 1.337 0.06 0 C-N-CA 126.318 1.847 . . . . 0.0 112.969 -169.873 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -53.34 -49.88 66.17 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 122.99 0.516 . . . . 0.0 110.346 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 19.1 mp0 -68.06 -37.12 80.93 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 119.272 -0.394 . . . . 0.0 110.419 -178.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 43.7 mt -62.91 -45.94 90.14 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 118.928 0.786 . . . . 0.0 110.93 177.18 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -57.57 -50.87 71.69 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 173.064 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 59.4 tt0 -51.42 -53.29 38.28 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.056 0.942 . . . . 0.0 110.594 178.283 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 12.8 mt -52.22 -65.08 0.62 Allowed 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 125.839 1.656 . . . . 0.0 109.82 177.108 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 14.3 tt -59.4 -45.51 93.44 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 120.037 -0.665 . . . . 0.0 109.934 -173.067 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 20.3 tt0 -51.16 -59.39 4.24 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.681 0.792 . . . . 0.0 111.551 177.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 9.1 mttm -78.33 -53.6 7.11 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-O 121.388 0.613 . . . . 0.0 110.815 -173.234 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 68.0 mm-40 -77.14 -21.45 54.12 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 118.278 -0.868 . . . . 0.0 112.924 -169.703 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 11.1 mt -113.98 89.12 3.01 Favored 'General case' 0 N--CA 1.461 0.095 0 CA-C-N 120.263 1.392 . . . . 0.0 108.948 170.185 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 1.7 p -69.66 34.03 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.98 2.112 . . . . 0.0 113.179 -179.753 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 28.6 mt -83.47 69.36 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 -179.545 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.42 -47.29 89.13 Favored Glycine 0 CA--C 1.528 0.877 0 N-CA-C 109.284 -1.526 . . . . 0.0 109.284 171.387 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 26.4 p -71.13 75.8 0.68 Allowed 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 123.963 0.905 . . . . 0.0 108.611 169.7 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 62.3 mttm -48.23 94.69 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.552 1.541 . . . . 0.0 110.932 177.641 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 94.8 mt -48.46 -51.39 27.26 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 125.145 1.378 . . . . 0.0 112.555 -170.454 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -162.89 161.55 25.9 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 -173.056 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -37.17 -40.74 0.34 Allowed 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 127.671 2.388 . . . . 0.0 114.146 -171.289 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.34 -56.31 0.15 Allowed 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 126.1 1.76 . . . . 0.0 114.479 -179.131 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 62.6 tt0 -63.8 -44.61 92.79 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 121.257 0.551 . . . . 0.0 110.9 -175.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 53' ' ' ILE . . . . . 0.584 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.5 mp -61.25 -52.5 60.68 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 179.855 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 73.4 t -56.29 -44.55 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 C-N-CA 124.249 1.02 . . . . 0.0 110.231 -179.523 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -53.92 -55.13 29.74 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 119.194 0.906 . . . . 0.0 110.497 173.013 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 46.4 mt -53.78 -42.87 68.75 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 119.18 -0.438 . . . . 0.0 111.524 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 24.5 mmt -68.45 -61.79 1.68 Allowed 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.765 0.793 . . . . 0.0 109.832 178.22 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -43.89 -43.52 6.45 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 127.085 2.154 . . . . 0.0 111.199 -177.388 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -39.13 -49.07 1.79 Allowed 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.831 1.253 . . . . 0.0 112.42 178.229 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -60.03 -56.35 22.71 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.28 0.491 . . . . 0.0 109.89 -177.649 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -61.79 -35.5 78.36 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 124.291 1.037 . . . . 0.0 111.482 -177.898 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 10.9 ttp180 -67.11 -52.24 44.28 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 123.759 0.824 . . . . 0.0 109.611 179.015 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -76.69 -58.38 3.32 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-O 119.628 -0.225 . . . . 0.0 110.558 -171.877 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 47.1 mtmt 48.56 44.77 21.1 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 121.193 0.521 . . . . 0.0 110.13 -169.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 70.74 -4.18 1.76 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.249 1.82 . . . . 0.0 113.927 -178.918 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -69.06 141.95 54.65 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 119.491 1.041 . . . . 0.0 109.1 176.086 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 41.5 mp0 -79.52 114.87 18.79 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 108.733 -0.839 . . . . 0.0 108.733 174.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 20.1 m -79.02 151.48 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 173.371 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -93.15 -175.93 4.0 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 123.832 0.853 . . . . 0.0 111.179 178.221 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -46.72 -66.08 0.46 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.109 0.964 . . . . 0.0 112.622 175.458 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 10.3 tp-100 -61.39 -35.1 76.54 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 119.756 1.162 . . . . 0.0 111.454 -174.056 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -64.51 -42.51 95.77 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 119.408 1.004 . . . . 0.0 111.252 175.424 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 73' ' ' TYR . . . . . 0.408 ' CE2' ' HB2' ' B' ' 16' ' ' PHE . 0.3 OUTLIER -54.81 -52.7 61.87 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 121.286 -0.884 . . . . 0.0 109.686 170.069 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 20.8 mm -53.68 -40.61 43.53 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.375 0 C-N-CA 122.947 0.499 . . . . 0.0 109.665 177.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 91.5 m -63.63 -28.37 69.87 Favored 'General case' 0 C--N 1.332 -0.178 0 C-N-CA 123.592 0.757 . . . . 0.0 111.338 178.307 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 10.7 t80 -60.51 -54.51 44.66 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.384 0.993 . . . . 0.0 108.996 171.508 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 70.1 mt -64.44 -37.98 89.44 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.183 0.593 . . . . 0.0 111.703 179.889 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -70.63 -45.03 55.6 Favored Glycine 0 CA--C 1.523 0.541 0 N-CA-C 110.047 -1.221 . . . . 0.0 110.047 -176.895 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.88 -46.24 90.25 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 122.294 -0.533 . . . . 0.0 109.898 173.456 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 26.4 tp -51.52 -57.99 7.55 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.211 0.529 . . . . 0.0 109.882 175.132 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.14 -51.99 38.84 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 124.42 1.088 . . . . 0.0 110.691 177.502 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 57.7 ttm -56.47 -51.01 70.06 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 124.316 1.047 . . . . 0.0 110.82 -178.515 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.3 mt -66.35 -51.03 63.02 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 CA-C-O 118.088 -0.958 . . . . 0.0 109.882 -173.507 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.464 0.1 OUTLIER -76.98 -40.25 47.47 Favored 'General case' 0 C--N 1.347 0.478 0 CA-C-N 119.716 1.144 . . . . 0.0 113.373 -177.302 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 19.3 m-80 -82.98 64.88 7.83 Favored 'General case' 0 N--CA 1.461 0.077 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 169.166 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -47.38 -26.49 1.32 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.945 1.698 . . . . 0.0 113.961 -172.018 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -38.81 -45.16 1.11 Allowed 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.505 1.522 . . . . 0.0 111.92 167.503 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 86.8 mt -67.92 6.65 0.66 Allowed 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.235 1.414 . . . . 0.0 113.758 -177.789 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 9.5 mtmp? -106.77 -4.53 19.26 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 119.517 1.053 . . . . 0.0 111.253 169.123 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.097 0 CA-C-O 117.663 -1.632 . . . . 0.0 110.675 -177.131 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.8 ptm . . . . . 0 N--CA 1.478 0.928 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -73.63 76.93 1.51 Allowed 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.409 0.684 . . . . 0.0 111.98 -170.601 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -53.5 163.82 0.95 Allowed Pre-proline 0 CA--C 1.54 0.568 0 C-N-CA 126.404 1.881 . . . . 0.0 111.627 172.552 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -51.65 -47.48 26.07 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 122.804 2.336 . . . . 0.0 112.309 176.239 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.421 HD23 ' HA ' ' A' ' 5' ' ' LEU . 8.6 mt -58.41 -50.43 73.71 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-N 118.322 0.51 . . . . 0.0 110.696 175.508 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -53.89 -48.81 69.73 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.147 0.431 . . . . 0.0 109.917 -178.119 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -57.78 -52.48 65.28 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.864 0.865 . . . . 0.0 110.919 177.655 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.31 -44.53 87.58 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.272 0.629 . . . . 0.0 111.781 -174.846 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 80.8 mt -54.54 -51.62 48.42 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 170.221 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.28 -49.64 14.37 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 124.358 0.98 . . . . 0.0 111.773 173.842 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.1 mt -55.61 -56.7 17.27 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 117.642 0.721 . . . . 0.0 111.094 174.561 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 9.9 mp -58.0 -43.39 86.58 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 119.357 0.98 . . . . 0.0 111.926 -177.885 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 75.4 mt -57.46 -55.88 18.5 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 C-N-CA 123.642 0.777 . . . . 0.0 110.131 174.035 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.81 -48.37 72.63 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.519 -1.032 . . . . 0.0 110.519 -177.293 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 7.4 mm -53.49 -48.57 57.8 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 C-N-CA 123.89 0.876 . . . . 0.0 109.975 174.278 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -56.47 -59.87 4.35 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.533 0.606 . . . . 0.0 109.96 177.076 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.6 t-80 -52.29 -38.34 58.12 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.218 1.007 . . . . 0.0 111.583 -177.014 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -56.51 -29.29 61.67 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.276 1.03 . . . . 0.0 112.163 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -110.8 -40.21 4.61 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.383 0.673 . . . . 0.0 112.262 -179.568 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 85.8 p -79.98 -46.34 16.84 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 119.462 1.028 . . . . 0.0 111.0 178.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -79.64 61.78 4.21 Favored Glycine 0 C--N 1.334 0.439 0 C-N-CA 124.955 1.264 . . . . 0.0 111.974 -169.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 21.5 mmmt -103.73 -52.74 2.91 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 171.605 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -169.24 176.62 5.12 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 126.068 1.747 . . . . 0.0 107.261 176.292 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 68.19 -149.3 49.92 Favored Glycine 0 CA--C 1.53 1.025 0 N-CA-C 112.219 -0.352 . . . . 0.0 112.219 174.166 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 62.8 t0 -78.99 68.81 5.03 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.342 0.657 . . . . 0.0 109.917 -173.135 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.8 ptmm? -61.3 -7.85 3.29 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 114.687 1.366 . . . . 0.0 114.687 -177.8 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 15.1 t-80 -75.95 -5.94 48.6 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.261 0.482 . . . . 0.0 110.193 170.917 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 19.2 p -135.46 165.11 26.26 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.192 1.397 . . . . 0.0 110.497 -179.287 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -160.74 167.1 27.55 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 124.808 1.243 . . . . 0.0 108.219 168.553 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 6.5 t -121.12 -169.88 1.92 Allowed 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 122.391 1.091 . . . . 0.0 113.575 -172.75 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 43.5 pttt -45.97 -55.76 6.4 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 127.879 2.472 . . . . 0.0 113.564 -169.904 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -56.3 -51.83 66.76 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 -178.019 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -57.98 -41.62 83.34 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.386 0.675 . . . . 0.0 110.891 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 42.3 mt -65.73 -48.76 70.83 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.496 0.589 . . . . 0.0 111.862 178.658 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -58.3 -46.15 86.66 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 121.786 -0.571 . . . . 0.0 109.805 176.771 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -58.05 -49.33 77.26 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-O 118.889 -0.577 . . . . 0.0 110.42 174.575 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.1 mt -48.24 -52.3 21.67 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 119.513 1.051 . . . . 0.0 110.114 177.857 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 49.3 mt -56.56 -62.63 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.206 174.098 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.5 tt0 -49.2 -46.74 46.1 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.325 0.65 . . . . 0.0 112.599 -173.846 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.9 mmpt? -80.94 -53.92 6.03 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 125.592 1.557 . . . . 0.0 110.149 -171.319 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -95.22 -14.57 23.94 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -168.005 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.7 mt -121.12 81.17 1.74 Allowed 'General case' 0 C--N 1.337 0.034 0 C-N-CA 125.327 1.451 . . . . 0.0 108.059 173.3 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 64.9 p -79.62 47.64 0.86 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.104 0.961 . . . . 0.0 109.924 -176.181 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 22.8 mt -84.1 75.22 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 -173.365 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -52.45 -46.95 57.75 Favored Glycine 0 CA--C 1.529 0.916 0 N-CA-C 110.084 -1.206 . . . . 0.0 110.084 171.198 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 6.1 m -70.89 67.62 0.4 Allowed 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.376 1.07 . . . . 0.0 110.166 171.583 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.61 ' HB3' HD11 ' A' ' 53' ' ' ILE . 63.3 mmtt -46.27 92.03 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.838 2.055 . . . . 0.0 112.47 -174.286 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 90.4 mt -62.6 112.78 2.63 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.103 0.961 . . . . 0.0 113.103 -170.246 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 67.86 -69.01 0.15 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 126.544 1.937 . . . . 0.0 114.086 167.23 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.6 p-10 -179.21 -38.92 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 125.724 1.609 . . . . 0.0 110.253 -170.376 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -36.2 -58.82 0.66 Allowed 'General case' 0 C--O 1.226 -0.17 0 C-N-CA 125.352 1.461 . . . . 0.0 113.593 -173.208 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -65.74 -39.87 91.55 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 120.771 0.319 . . . . 0.0 111.057 -173.076 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.68 HD12 ' H ' ' A' ' 53' ' ' ILE . 2.1 mp -61.14 -54.88 29.16 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 178.933 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 80.6 t -56.25 -45.31 81.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 C-N-CA 123.973 0.909 . . . . 0.0 110.285 -179.742 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.19 -52.83 63.73 Favored 'General case' 0 C--O 1.23 0.053 0 CA-C-N 118.846 0.748 . . . . 0.0 110.235 176.367 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 61.5 mt -55.0 -40.44 70.13 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 119.282 -0.39 . . . . 0.0 111.192 -179.483 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.25 -67.74 0.44 Allowed 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 118.523 0.601 . . . . 0.0 109.645 174.23 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -39.7 -41.3 1.06 Allowed 'General case' 0 C--N 1.34 0.152 0 C-N-CA 127.37 2.268 . . . . 0.0 112.097 -177.125 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -38.64 -49.96 1.58 Allowed 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.825 1.25 . . . . 0.0 112.19 175.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.7 pp -60.87 -41.56 96.19 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 118.333 0.515 . . . . 0.0 110.95 -176.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -71.46 -42.72 67.82 Favored 'General case' 0 N--CA 1.457 -0.11 0 C-N-CA 123.619 0.768 . . . . 0.0 109.762 -178.492 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 14.5 ttm180 -59.1 -48.28 82.17 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.894 0.877 . . . . 0.0 110.208 178.464 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 8.4 m-80 -84.61 -47.9 10.05 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.547 0.339 . . . . 0.0 111.696 -171.02 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 57.9 mttp 54.64 -95.07 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.141 0.977 . . . . 0.0 109.185 -167.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -140.88 42.63 1.83 Allowed 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 119.039 0.836 . . . . 0.0 109.862 169.871 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -118.81 156.04 30.11 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.596 1.158 . . . . 0.0 108.853 172.574 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -87.22 130.03 34.73 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 169.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 11.0 m -79.55 143.3 12.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 170.206 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -83.38 167.81 17.18 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 122.78 0.432 . . . . 0.0 111.382 177.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 61.1 t80 -37.4 -59.18 0.78 Allowed 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.508 1.123 . . . . 0.0 113.149 177.143 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 53.8 tp60 -64.9 -32.22 73.82 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 119.716 1.144 . . . . 0.0 111.153 -175.738 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -68.87 -40.27 79.38 Favored 'General case' 0 CA--C 1.533 0.304 0 O-C-N 121.537 -0.727 . . . . 0.0 110.539 176.672 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -56.14 -51.94 66.13 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 169.584 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.416 ' CG2' ' CG2' ' B' ' 74' ' ' ILE . 24.5 mm -56.78 -35.86 47.5 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 O-C-N 121.915 -0.491 . . . . 0.0 110.305 176.669 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 90.2 m -71.69 -34.52 69.73 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 119.217 0.917 . . . . 0.0 111.42 176.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -58.73 -51.93 67.86 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 119.106 0.866 . . . . 0.0 108.923 171.631 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 64.3 mt -59.96 -40.92 90.68 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 120.926 0.393 . . . . 0.0 111.322 174.159 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -59.7 -47.28 91.69 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 110.533 -1.027 . . . . 0.0 110.533 -179.772 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.03 -48.3 82.4 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.925 0.89 . . . . 0.0 109.694 176.311 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 8.9 tp -51.06 -60.27 3.28 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-O 121.981 0.896 . . . . 0.0 110.002 177.031 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -49.14 -54.93 14.02 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 125.518 1.527 . . . . 0.0 110.528 179.098 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 18.4 ttp -67.92 -33.6 75.0 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.772 0.829 . . . . 0.0 111.99 -174.199 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 90.9 mt -67.49 -58.42 6.29 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.346 0 CA-C-O 118.407 -0.806 . . . . 0.0 108.99 176.3 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.417 0.7 OUTLIER -70.8 -38.89 73.37 Favored 'General case' 0 C--N 1.346 0.436 0 C-N-CA 118.173 -1.411 . . . . 0.0 112.521 -174.542 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 29.7 m-80 -82.18 65.44 7.31 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 168.903 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -46.99 -32.58 3.99 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.517 1.127 . . . . 0.0 113.004 -172.104 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.94 -52.25 0.43 Allowed 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.85 1.66 . . . . 0.0 112.494 168.633 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 90.1 mt -61.45 -16.06 43.27 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.2 1.0 . . . . 0.0 113.455 -174.634 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -65.34 -20.97 66.63 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 119.031 0.832 . . . . 0.0 111.285 173.072 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.181 0 CA-C-O 116.824 -2.098 . . . . 0.0 112.504 178.006 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 96.3 mmm . . . . . 0 N--CA 1.474 0.76 0 CA-C-O 120.678 0.275 . . . . 0.0 110.288 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.08 68.89 3.29 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 121.983 -0.448 . . . . 0.0 110.222 176.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.7 m -51.26 159.86 1.02 Allowed Pre-proline 0 CA--C 1.537 0.468 0 C-N-CA 124.959 1.304 . . . . 0.0 110.688 173.625 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_exo -44.81 -49.87 9.09 Favored 'Trans proline' 0 N--CA 1.459 -0.52 0 C-N-CA 123.276 2.65 . . . . 0.0 113.401 -178.423 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.4 mt -57.95 -53.42 58.47 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 174.788 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -58.35 -40.44 82.22 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 118.265 0.484 . . . . 0.0 110.029 -175.741 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -64.12 -50.69 67.27 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.462 1.105 . . . . 0.0 110.52 178.605 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.35 -46.12 91.54 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.602 0.715 . . . . 0.0 111.103 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 64.9 mt -52.8 -53.01 23.13 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 170.139 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.76 -47.25 24.75 Favored Glycine 0 CA--C 1.527 0.796 0 C-N-CA 125.172 1.368 . . . . 0.0 111.784 176.082 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 mt -55.93 -55.34 33.82 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 117.606 0.703 . . . . 0.0 110.89 173.63 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -57.54 -43.66 84.55 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 118.864 0.757 . . . . 0.0 111.612 -179.83 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 89.1 mt -58.35 -52.75 55.32 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 C-N-CA 123.554 0.741 . . . . 0.0 110.69 174.414 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.0 -51.97 50.08 Favored Glycine 0 CA--C 1.523 0.543 0 N-CA-C 109.614 -1.394 . . . . 0.0 109.614 -178.026 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 9.1 mm -53.51 -49.93 52.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 C-N-CA 123.635 0.774 . . . . 0.0 110.474 175.377 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -51.76 -59.46 4.28 Favored 'General case' 0 C--N 1.339 0.134 0 CA-C-O 120.929 0.395 . . . . 0.0 110.059 178.321 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 67.9 t60 -55.04 -46.39 75.31 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.262 0.625 . . . . 0.0 110.635 -177.632 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -51.15 -28.83 11.89 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 125.546 1.539 . . . . 0.0 112.721 -179.423 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -132.27 44.6 2.87 Favored 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 119.006 0.821 . . . . 0.0 110.01 173.367 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 58.6 p -83.11 -102.31 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 121.601 0.715 . . . . 0.0 111.769 -176.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -139.63 62.95 0.55 Allowed Glycine 0 C--N 1.333 0.374 0 N-CA-C 109.631 -1.388 . . . . 0.0 109.631 -168.693 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 30.1 mmtp -50.63 -33.36 21.97 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.716 1.207 . . . . 0.0 112.322 -174.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -62.46 -20.59 64.69 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -177.15 -87.28 0.07 OUTLIER Glycine 0 CA--C 1.525 0.712 0 CA-C-N 118.545 0.612 . . . . 0.0 111.726 178.6 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -78.47 95.72 5.21 Favored 'General case' 0 C--N 1.338 0.091 0 CA-C-N 117.307 0.553 . . . . 0.0 109.556 -173.756 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 18.9 mttm -79.04 42.78 0.48 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.864 0.866 . . . . 0.0 112.168 -174.354 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 19.2 m80 -144.61 0.87 1.01 Allowed 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 127.349 2.26 . . . . 0.0 111.358 -173.065 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 3.4 p -128.84 169.85 14.08 Favored 'General case' 0 C--O 1.232 0.151 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 169.893 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 29' ' ' LEU . . . . . 0.427 HD12 ' CG2' ' B' ' 68' ' ' VAL . 4.3 pp -159.34 -170.84 3.1 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.593 0.757 . . . . 0.0 109.619 175.247 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 14.4 m -149.69 178.82 8.52 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.125 -0.984 . . . . 0.0 111.357 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 19.4 pttm -37.23 -53.2 1.06 Allowed 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 126.576 1.95 . . . . 0.0 113.727 -179.487 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 23.1 ttmm -50.98 -50.35 58.39 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.782 0.833 . . . . 0.0 110.544 178.119 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 25.8 mp0 -67.39 -39.01 85.56 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 118.723 -0.656 . . . . 0.0 110.143 -178.303 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 78.0 mt -60.36 -46.43 89.98 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.373 0.988 . . . . 0.0 111.127 175.476 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -56.8 -51.43 68.96 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 175.197 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -55.64 -48.22 75.33 Favored 'General case' 0 C--O 1.22 -0.448 0 CA-C-N 117.861 0.3 . . . . 0.0 111.361 175.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 15.1 mt -51.77 -53.52 38.84 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 121.504 -0.748 . . . . 0.0 109.776 -178.739 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 1.4 mp -57.13 -58.14 7.13 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 174.623 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -53.5 -47.77 69.58 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.574 0.75 . . . . 0.0 112.037 -172.085 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 10.7 mmpt? -82.66 -49.39 9.86 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 125.204 1.402 . . . . 0.0 110.211 -173.25 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 52.7 mm-40 -98.98 -2.47 37.29 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-O 117.248 -1.358 . . . . 0.0 114.424 -167.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 72.1 mt -126.03 90.04 3.13 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 120.673 1.579 . . . . 0.0 110.214 169.666 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 37.9 p -73.79 65.87 1.06 Allowed 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.201 1.0 . . . . 0.0 108.302 169.65 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 10.8 tt -78.24 59.2 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 124.96 1.304 . . . . 0.0 111.725 -169.202 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 63.94 -76.95 0.05 OUTLIER Glycine 0 CA--C 1.526 0.754 0 C-N-CA 125.882 1.706 . . . . 0.0 111.312 -178.077 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 36.7 m -163.63 56.69 0.17 Allowed 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 126.659 1.984 . . . . 0.0 107.24 176.342 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp 55.67 51.28 12.77 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.128 0.971 . . . . 0.0 110.204 -173.381 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 4.3 pp -72.02 138.35 47.86 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 119.684 -0.806 . . . . 0.0 110.069 174.616 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 72.75 119.7 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.677 1.991 . . . . 0.0 113.003 171.635 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -42.23 -38.98 1.92 Allowed 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 127.12 2.168 . . . . 0.0 114.959 -169.514 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.94 -60.58 0.16 Allowed 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 125.851 1.661 . . . . 0.0 113.524 -178.362 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -68.55 -34.57 76.08 Favored 'General case' 0 N--CA 1.457 -0.111 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -174.085 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 53' ' ' ILE . . . . . 0.509 HD12 ' N ' ' B' ' 53' ' ' ILE . 1.2 mp -65.87 -52.54 48.25 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 -178.657 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 80.3 t -54.31 -45.49 68.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 C-N-CA 123.699 0.799 . . . . 0.0 110.093 174.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.41 -50.64 72.36 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 118.482 0.583 . . . . 0.0 110.926 177.263 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 54.4 mt -56.19 -39.87 73.09 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.202 0.601 . . . . 0.0 111.284 178.685 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.44 -64.95 0.75 Allowed 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 118.762 0.71 . . . . 0.0 109.085 174.186 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -40.51 -42.51 1.66 Allowed 'General case' 0 N--CA 1.463 0.209 0 C-N-CA 126.637 1.975 . . . . 0.0 111.943 -178.147 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -38.13 -48.65 1.26 Allowed 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 126.001 1.72 . . . . 0.0 112.634 177.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.6 pp -63.11 -42.23 99.51 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 121.078 -0.249 . . . . 0.0 110.833 -176.288 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -73.59 -37.76 65.34 Favored 'General case' 0 N--CA 1.457 -0.085 0 C-N-CA 123.791 0.836 . . . . 0.0 110.257 -178.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 15.6 ttm180 -58.38 -48.5 80.4 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.325 0.65 . . . . 0.0 109.614 175.092 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -81.7 -66.61 0.87 Allowed 'General case' 0 C--O 1.232 0.166 0 C-N-CA 122.222 0.209 . . . . 0.0 111.311 -174.412 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 23.1 mtmm 61.84 -75.89 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.733 1.613 . . . . 0.0 108.76 -167.356 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -138.49 -12.38 1.35 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.556 1.542 . . . . 0.0 112.087 175.094 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.6 104.26 8.03 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 118.997 0.817 . . . . 0.0 109.979 -173.128 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 26.9 mp0 -49.8 124.68 10.22 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.647 0.779 . . . . 0.0 109.368 169.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 68' ' ' VAL . . . . . 0.427 ' CG2' HD12 ' B' ' 29' ' ' LEU . 29.5 m -85.91 155.86 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 CA-C-O 121.33 0.586 . . . . 0.0 109.896 -177.686 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 16.7 p30 -105.17 -176.79 3.18 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 126.184 1.794 . . . . 0.0 110.928 179.426 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -52.93 -63.48 1.13 Allowed 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 123.637 0.775 . . . . 0.0 112.183 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -62.76 -32.68 73.87 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 119.703 1.138 . . . . 0.0 111.327 -175.487 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -59.16 -50.52 73.72 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 119.525 1.057 . . . . 0.0 110.666 173.564 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -53.9 -49.75 67.9 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.957 -0.464 . . . . 0.0 110.227 173.245 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 0.416 ' CG2' ' CG2' ' A' ' 74' ' ' ILE . 26.2 mm -60.85 -27.18 40.65 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 O-C-N 121.934 -0.479 . . . . 0.0 111.18 177.343 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 83.6 m -76.12 -33.94 59.46 Favored 'General case' 0 C--N 1.333 -0.114 0 O-C-N 120.898 -1.126 . . . . 0.0 110.154 173.698 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -57.34 -57.98 10.26 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 169.831 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 48.4 mt -61.37 -40.31 93.84 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 120.943 0.401 . . . . 0.0 111.996 179.127 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.3 -47.06 65.81 Favored Glycine 0 CA--C 1.524 0.651 0 N-CA-C 110.721 -0.952 . . . . 0.0 110.721 -176.461 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.28 -44.58 87.54 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 121.867 -0.784 . . . . 0.0 110.174 176.228 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 13.9 tp -48.29 -56.83 7.04 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.604 0.761 . . . . 0.0 110.145 172.55 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.05 -55.0 23.39 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.474 1.11 . . . . 0.0 110.612 175.795 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 39.5 ttm -51.33 -47.13 62.79 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.243 1.017 . . . . 0.0 110.982 -178.136 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 60.6 mt -68.8 -61.21 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-O 118.321 -0.847 . . . . 0.0 110.566 178.701 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.39 0.3 OUTLIER -65.7 -44.47 86.06 Favored 'General case' 0 C--N 1.346 0.434 0 C-N-CA 117.891 -1.524 . . . . 0.0 112.02 -171.331 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 64.7 m-80 -82.94 62.57 6.57 Favored 'General case' 0 C--O 1.228 -0.047 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 169.594 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -49.21 -30.07 6.49 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.196 1.398 . . . . 0.0 112.268 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -40.37 -37.94 0.74 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.795 1.638 . . . . 0.0 113.138 169.65 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 28.5 mt -53.42 -38.84 63.86 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.788 0.835 . . . . 0.0 111.988 176.831 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 65.1 mttm -75.32 54.41 0.72 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.342 1.057 . . . . 0.0 111.4 -175.385 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.09 0 CA-C-O 117.729 -1.595 . . . . 0.0 109.965 178.807 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.3 mpp? . . . . . 0 N--CA 1.474 0.746 0 CA-C-O 120.74 0.305 . . . . 0.0 110.852 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -76.56 70.96 3.15 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.141 0.577 . . . . 0.0 110.75 -176.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.1 m -57.39 165.78 1.95 Allowed Pre-proline 0 CA--C 1.54 0.594 0 C-N-CA 124.915 1.286 . . . . 0.0 111.885 178.039 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -47.19 -47.43 17.11 Favored 'Trans proline' 0 N--CA 1.458 -0.578 0 C-N-CA 123.575 2.85 . . . . 0.0 113.376 178.735 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.7 mt -55.42 -49.62 71.93 Favored 'General case' 0 C--N 1.341 0.204 0 CA-C-N 118.01 0.368 . . . . 0.0 111.495 173.852 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -61.52 -41.31 97.13 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 -176.391 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 17.0 tt0 -60.48 -51.78 67.99 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.33 0.652 . . . . 0.0 110.831 175.855 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.06 -45.83 90.35 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.527 0.731 . . . . 0.0 111.227 -177.296 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 66.7 mt -53.1 -53.5 22.16 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 169.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -45.78 -47.83 13.49 Favored Glycine 0 CA--C 1.528 0.902 0 C-N-CA 125.188 1.375 . . . . 0.0 112.156 175.494 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.0 mt -54.95 -56.48 19.19 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 117.733 0.766 . . . . 0.0 110.861 173.929 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.4 mp -58.17 -43.95 87.73 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 121.611 -0.681 . . . . 0.0 111.601 -179.285 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 60.7 mt -55.41 -56.04 13.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.18 0 C-N-CA 123.727 0.811 . . . . 0.0 109.975 174.025 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.01 -49.63 61.92 Favored Glycine 0 CA--C 1.523 0.56 0 N-CA-C 110.268 -1.133 . . . . 0.0 110.268 -177.547 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 8.8 mm -53.34 -48.5 56.16 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 C-N-CA 123.242 0.617 . . . . 0.0 110.454 176.52 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -56.54 -60.93 2.82 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 121.684 0.754 . . . . 0.0 109.892 175.934 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -53.76 -37.39 63.36 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.854 1.262 . . . . 0.0 111.616 -172.659 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.5 tttp -50.28 -36.92 33.59 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.2 1.0 . . . . 0.0 111.855 177.151 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -102.28 -52.14 3.2 Favored 'General case' 0 CA--C 1.528 0.111 0 C-N-CA 123.064 0.545 . . . . 0.0 109.682 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.6 m -59.41 -37.77 78.89 Favored 'General case' 0 N--CA 1.453 -0.292 0 O-C-N 121.759 -0.588 . . . . 0.0 112.431 -175.549 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -72.89 63.72 1.58 Allowed Glycine 0 C--N 1.339 0.721 0 C-N-CA 124.394 0.997 . . . . 0.0 113.055 -172.452 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.5 pttp -170.12 -33.69 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.728 1.611 . . . . 0.0 111.196 174.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -76.72 38.63 0.2 Allowed 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 119.647 1.112 . . . . 0.0 113.693 -173.841 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.01 -75.89 0.12 Allowed Glycine 0 CA--C 1.53 0.998 0 O-C-N 121.399 -0.813 . . . . 0.0 111.203 -175.597 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 67.1 t0 -78.71 78.57 5.15 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 13.0 ptmm? -60.79 -9.93 4.76 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 -178.694 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 26.5 t-80 -78.62 -11.58 59.98 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.844 0.747 . . . . 0.0 111.349 173.879 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.9 p -122.35 166.43 14.71 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 125.603 1.561 . . . . 0.0 111.431 178.559 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -151.62 164.34 37.1 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 124.088 0.955 . . . . 0.0 109.079 168.12 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 84.3 p -87.04 165.28 15.93 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.66 1.184 . . . . 0.0 113.125 -172.834 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 24.2 pttm -48.83 -47.34 42.54 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.395 168.075 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -57.28 -53.28 59.88 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 124.542 1.137 . . . . 0.0 109.37 178.536 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -56.62 -43.65 80.42 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 118.208 -0.901 . . . . 0.0 111.812 178.146 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.8 mt -60.4 -52.29 65.84 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 119.881 1.219 . . . . 0.0 111.597 175.549 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.9 mtmt -58.48 -38.21 77.12 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 122.374 0.27 . . . . 0.0 110.803 -178.565 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -60.62 -70.39 0.18 Allowed 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 168.824 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.3 mt -32.16 -60.23 0.28 Allowed 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 126.175 1.79 . . . . 0.0 112.341 -176.397 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 15.4 tt -56.34 -54.17 31.21 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 O-C-N 123.464 0.477 . . . . 0.0 109.874 -173.592 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -69.01 -40.46 78.66 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.851 -0.531 . . . . 0.0 111.733 -176.389 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.8 mmpt? -60.93 -54.26 47.14 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 123.692 0.797 . . . . 0.0 109.691 -178.841 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 65.8 mm-40 -84.68 -49.96 8.05 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.399 -169.728 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 98.4 mt -78.0 73.88 4.55 Favored 'General case' 0 C--N 1.339 0.128 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 170.428 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 21.0 p -50.5 -43.97 55.85 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 170.029 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . 0.271 4.3 tt 52.06 -56.38 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 C-N-CA 130.195 3.398 . . . . 0.0 117.444 167.681 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 135.99 -162.42 24.99 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 107.017 -2.433 . . . . 0.0 107.017 -170.584 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 3.7 m -74.02 60.6 0.78 Allowed 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.988 0.915 . . . . 0.0 112.84 -174.35 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 61.2 mttp 49.26 61.74 2.98 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.726 1.211 . . . . 0.0 110.091 178.517 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 26.2 mt -44.61 -43.69 8.36 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 115.608 1.707 . . . . 0.0 115.608 -168.322 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 44.3 tt0 -147.51 140.3 24.87 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 118.473 0.579 . . . . 0.0 109.935 -168.406 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -36.68 -44.74 0.48 Allowed 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 128.47 2.708 . . . . 0.0 113.748 -169.288 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -36.87 -51.16 0.89 Allowed 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 124.661 1.184 . . . . 0.0 112.799 179.672 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -65.95 -39.32 90.34 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 121.256 0.55 . . . . 0.0 111.103 -175.195 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.509 ' N ' HD12 ' A' ' 53' ' ' ILE . 1.1 mp -65.36 -51.98 57.71 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 N-CA-C 106.904 -1.517 . . . . 0.0 106.904 -179.708 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 84.6 t -56.69 -44.17 80.76 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 C-N-CA 123.892 0.877 . . . . 0.0 110.324 178.853 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -56.65 -53.45 57.5 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 118.65 0.659 . . . . 0.0 110.195 173.945 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 40.8 mt -53.13 -44.3 67.61 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 119.204 -0.427 . . . . 0.0 111.521 178.662 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 26.2 mmt -64.89 -57.82 7.79 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.797 0.808 . . . . 0.0 109.885 177.71 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -56.29 -32.94 65.05 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 125.272 1.429 . . . . 0.0 111.835 -173.547 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -38.59 -47.66 1.34 Allowed 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 125.314 1.446 . . . . 0.0 112.397 -178.191 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -55.83 -48.33 75.65 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 122.348 0.259 . . . . 0.0 110.708 -178.719 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -67.61 -45.34 75.72 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 123.139 0.576 . . . . 0.0 110.198 176.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 14.2 ttt85 -53.46 -43.5 68.16 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.954 0.902 . . . . 0.0 111.014 -178.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 16.3 m-80 -84.8 -5.54 59.33 Favored 'General case' 0 N--CA 1.462 0.138 0 C-N-CA 123.95 0.9 . . . . 0.0 112.401 177.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 93.0 mttt 45.56 48.62 11.12 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.605 1.162 . . . . 0.0 110.023 -168.887 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 56.91 26.74 12.08 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 126.411 1.884 . . . . 0.0 113.196 -178.369 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -137.83 -100.69 0.19 Allowed 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.952 0.901 . . . . 0.0 111.76 179.638 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.5 mp0 -135.61 167.03 21.86 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 125.659 1.584 . . . . 0.0 111.107 -168.31 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 15.5 m -137.03 156.31 34.13 Favored 'Isoleucine or valine' 0 C--O 1.235 0.303 0 C-N-CA 125.37 1.468 . . . . 0.0 108.844 168.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -88.67 168.48 12.48 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 124.016 0.926 . . . . 0.0 111.622 175.142 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -36.63 -62.0 0.49 Allowed 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.512 1.125 . . . . 0.0 113.447 172.79 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 43.7 tp60 -63.29 -34.09 76.94 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 120.851 -1.156 . . . . 0.0 111.235 -174.28 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -66.28 -41.4 89.87 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.366 -0.834 . . . . 0.0 110.371 175.702 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -54.49 -49.27 70.53 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 121.614 -0.678 . . . . 0.0 109.651 169.74 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.407 ' CG2' ' CG2' ' B' ' 74' ' ' ILE . 29.6 mm -58.65 -32.8 47.09 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 O-C-N 121.764 -0.585 . . . . 0.0 110.676 175.3 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 25.5 m -72.13 -30.97 65.58 Favored 'General case' 0 CA--C 1.534 0.345 0 O-C-N 121.232 -0.917 . . . . 0.0 111.253 175.363 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -61.77 -56.48 19.05 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.083 -1.011 . . . . 0.0 108.739 171.76 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 49.2 mt -61.49 -41.97 98.08 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 120.875 0.369 . . . . 0.0 111.418 178.865 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.8 -46.36 89.88 Favored Glycine 0 CA--C 1.523 0.587 0 N-CA-C 110.663 -0.975 . . . . 0.0 110.663 -178.215 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.97 -45.91 92.84 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 117.97 0.885 . . . . 0.0 110.423 174.758 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 16.8 tp -51.73 -55.74 17.85 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.18 0.514 . . . . 0.0 109.807 176.445 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.83 -56.14 15.74 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 124.75 1.22 . . . . 0.0 110.163 179.261 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 54.5 ttm -50.43 -52.6 36.32 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 125.6 1.56 . . . . 0.0 110.574 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 71.3 mt -64.84 -64.41 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.346 0 CA-C-O 118.748 -0.644 . . . . 0.0 109.403 -177.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.448 0.1 OUTLIER -67.47 -37.1 82.39 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 118.314 -1.354 . . . . 0.0 113.253 -169.245 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 24.1 m-80 -81.51 68.79 7.98 Favored 'General case' 0 N--CA 1.461 0.101 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 170.054 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -37.62 -46.64 0.88 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.503 1.521 . . . . 0.0 111.619 -176.074 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -30.93 -53.51 0.19 Allowed 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 126.756 2.022 . . . . 0.0 113.506 171.502 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 18.7 mt -46.98 -40.37 14.3 Favored 'General case' 0 C--O 1.224 -0.261 0 C-N-CA 123.996 0.919 . . . . 0.0 111.95 -178.293 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 53.4 mtmt -65.76 -15.64 63.03 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -173.743 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.052 0 CA-C-O 116.878 -2.068 . . . . 0.0 110.609 174.025 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 55.5 ttp . . . . . 0 N--CA 1.473 0.698 0 CA-C-O 120.636 0.255 . . . . 0.0 110.395 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -75.25 74.69 2.38 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 120.794 0.33 . . . . 0.0 110.621 -178.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 13.0 m -50.74 156.37 1.63 Allowed Pre-proline 0 CA--C 1.542 0.656 0 C-N-CA 123.56 0.744 . . . . 0.0 111.008 170.668 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -47.11 -51.5 9.29 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 123.23 2.62 . . . . 0.0 113.465 -178.01 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 4.9 mt -52.79 -46.89 67.84 Favored 'General case' 0 C--O 1.227 -0.124 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 172.418 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -63.48 -40.62 97.58 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 118.16 0.436 . . . . 0.0 110.1 -177.045 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 14.1 tp60 -63.4 -46.3 87.07 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 122.438 0.295 . . . . 0.0 110.7 175.47 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.76 -47.02 85.33 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.357 0.599 . . . . 0.0 110.872 -179.157 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 65.1 mt -53.15 -53.39 23.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 169.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.29 -44.8 21.11 Favored Glycine 0 CA--C 1.527 0.822 0 C-N-CA 125.588 1.566 . . . . 0.0 112.02 176.49 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.6 mt -57.27 -55.57 33.11 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 117.569 0.685 . . . . 0.0 110.587 173.612 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.9 mp -57.86 -41.99 83.58 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 118.996 0.816 . . . . 0.0 111.647 179.789 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 66.7 mt -57.13 -56.37 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 C-N-CA 123.841 0.856 . . . . 0.0 110.736 173.448 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.07 -50.55 58.62 Favored Glycine 0 CA--C 1.521 0.444 0 N-CA-C 109.751 -1.34 . . . . 0.0 109.751 -177.206 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 12.5 mm -52.1 -49.06 41.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 C-N-CA 123.47 0.708 . . . . 0.0 110.474 174.341 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -55.49 -65.36 0.6 Allowed 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 118.31 0.505 . . . . 0.0 110.18 178.335 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -58.92 -30.67 68.01 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 118.205 -0.902 . . . . 0.0 112.707 -174.398 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 65.3 tttp -49.13 -36.71 19.75 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 119.301 0.955 . . . . 0.0 111.293 173.33 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -100.68 -56.73 2.26 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 122.935 0.494 . . . . 0.0 110.169 177.459 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m -51.76 -39.77 59.12 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.832 0.742 . . . . 0.0 111.589 -176.83 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -33.96 -56.33 0.67 Allowed Glycine 0 C--N 1.338 0.686 0 C-N-CA 125.606 1.574 . . . . 0.0 113.275 173.706 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.3 -7.61 43.87 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 114.581 1.326 . . . . 0.0 114.581 -168.518 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -104.36 14.84 29.44 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 119.472 1.033 . . . . 0.0 112.269 173.554 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 77.89 -61.44 3.71 Favored Glycine 0 CA--C 1.527 0.798 0 O-C-N 121.621 -0.675 . . . . 0.0 112.508 168.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 61.7 t0 -78.28 63.21 3.13 Favored 'General case' 0 C--O 1.232 0.174 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 175.195 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 21.5 pttp -70.98 4.79 2.38 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 125.261 1.424 . . . . 0.0 113.789 -169.218 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 23.6 t-160 -76.92 -16.14 59.46 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 124.55 1.14 . . . . 0.0 109.055 167.5 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 32.2 p -133.48 160.83 36.25 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 125.177 1.391 . . . . 0.0 111.429 -174.208 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -161.34 177.72 9.88 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.831 1.252 . . . . 0.0 108.668 168.477 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.4 t -131.83 -169.44 2.2 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 120.259 1.39 . . . . 0.0 112.241 -175.112 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 19.2 pttp -42.25 -53.54 4.07 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 127.877 2.471 . . . . 0.0 113.227 -174.062 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 3.2 tppp? -55.67 -53.41 56.94 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 123.517 0.727 . . . . 0.0 109.568 -178.868 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 28.2 mp0 -64.44 -38.04 89.64 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.289 -176.65 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 43.6 mt -61.9 -52.59 63.46 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 118.542 0.61 . . . . 0.0 111.228 177.591 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -61.88 -43.78 98.14 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.545 -0.722 . . . . 0.0 110.506 178.413 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 71.6 tt0 -53.24 -51.96 60.51 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.758 0.823 . . . . 0.0 110.363 174.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 7.9 mt -49.49 -56.95 8.01 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 124.552 1.141 . . . . 0.0 110.13 177.391 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 33.7 mm -53.92 -58.99 2.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 177.503 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -54.31 -47.06 72.88 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.272 0.629 . . . . 0.0 112.425 -172.166 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -78.1 -56.28 4.6 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 122.096 -0.377 . . . . 0.0 110.745 -178.316 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -82.59 -20.55 36.26 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 -167.163 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 76.1 mt -110.76 90.13 3.24 Favored 'General case' 0 N--CA 1.457 -0.115 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 168.779 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 64.2 p -76.36 55.89 1.03 Allowed 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 124.255 1.022 . . . . 0.0 109.259 178.057 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 50.5 mt -100.33 73.07 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 N-CA-C 106.454 -1.684 . . . . 0.0 106.454 -178.369 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.5 -48.79 84.29 Favored Glycine 0 CA--C 1.528 0.902 0 N-CA-C 109.184 -1.567 . . . . 0.0 109.184 172.282 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 23.2 p -71.28 74.38 0.71 Allowed 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 124.128 0.971 . . . . 0.0 108.674 169.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 47' ' ' LYS . . . . . 0.522 ' HB3' HD11 ' B' ' 53' ' ' ILE . 47.6 mttp -51.01 95.17 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 125.487 1.515 . . . . 0.0 111.113 179.652 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 95.5 mt -42.27 -54.04 3.88 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 126.489 1.916 . . . . 0.0 112.973 -171.145 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -163.27 160.14 23.51 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 106.723 -1.584 . . . . 0.0 106.723 -172.394 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -36.62 -41.66 0.32 Allowed 'General case' 0 C--O 1.226 -0.136 0 C-N-CA 127.932 2.493 . . . . 0.0 114.184 -171.467 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.4 -57.41 0.15 Allowed 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 126.027 1.731 . . . . 0.0 113.906 -178.896 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -67.4 -41.91 84.15 Favored 'General case' 0 N--CA 1.457 -0.083 0 CA-C-O 120.849 0.356 . . . . 0.0 111.166 -174.773 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 53' ' ' ILE . . . . . 0.612 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.4 mp -60.65 -52.08 65.64 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 N-CA-C 107.066 -1.457 . . . . 0.0 107.066 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 78.4 t -54.49 -53.37 31.52 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 C-N-CA 123.914 0.886 . . . . 0.0 109.428 177.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -50.28 -55.17 16.57 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 119.317 0.962 . . . . 0.0 110.927 176.932 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 68.1 mt -54.67 -43.47 72.45 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 122.593 0.357 . . . . 0.0 111.655 -175.785 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -75.55 -59.67 2.65 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 118.097 0.408 . . . . 0.0 111.09 177.857 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -40.88 -43.71 2.12 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 126.458 1.903 . . . . 0.0 111.447 178.773 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -38.52 -49.01 1.47 Allowed 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 125.046 1.338 . . . . 0.0 112.547 176.636 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -58.6 -47.02 85.72 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 -176.814 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -67.91 -44.04 77.85 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 122.736 0.415 . . . . 0.0 110.724 178.44 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 11.2 ttp180 -56.55 -46.28 80.79 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.664 0.786 . . . . 0.0 110.095 -178.657 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -84.51 -54.08 4.99 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 122.879 0.472 . . . . 0.0 111.179 -174.904 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp 64.19 -80.67 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 -165.542 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -148.3 21.61 1.07 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.958 1.303 . . . . 0.0 110.798 169.892 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -77.51 143.45 38.43 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 121.611 -0.681 . . . . 0.0 109.466 178.243 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -89.44 107.97 19.38 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 106.237 -1.764 . . . . 0.0 106.237 168.676 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 12.2 m -78.17 140.22 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 -179.181 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -81.36 167.06 19.88 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.551 0.215 . . . . 0.0 110.71 175.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -32.37 -61.04 0.27 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.978 1.311 . . . . 0.0 112.902 171.589 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 37.8 tp60 -61.35 -33.3 73.39 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.604 1.093 . . . . 0.0 112.128 -174.726 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -72.53 -38.77 67.94 Favored 'General case' 0 C--O 1.236 0.35 0 O-C-N 121.338 -0.851 . . . . 0.0 110.16 177.87 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -56.14 -50.74 70.27 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 169.675 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 0.407 ' CG2' ' CG2' ' A' ' 74' ' ' ILE . 25.8 mm -55.82 -41.17 65.31 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 175.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 58.4 m -60.03 -37.95 81.28 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 118.976 0.807 . . . . 0.0 110.94 176.561 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 20.7 t80 -57.09 -53.97 52.1 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 121.726 -0.608 . . . . 0.0 109.842 174.223 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 60.2 mt -62.98 -38.27 90.45 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.979 0.419 . . . . 0.0 111.893 179.113 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.65 -43.51 84.99 Favored Glycine 0 CA--C 1.522 0.508 0 N-CA-C 110.0 -1.24 . . . . 0.0 110.0 -178.414 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.74 -48.31 82.37 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 117.553 0.676 . . . . 0.0 109.881 173.438 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 9.1 tp -50.39 -57.7 7.37 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 121.429 0.633 . . . . 0.0 110.054 175.426 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.5 -56.64 10.71 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 124.877 1.271 . . . . 0.0 110.433 179.018 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 43.8 ttm -52.57 -49.66 64.51 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 125.555 1.542 . . . . 0.0 110.665 -179.409 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 58.3 mt -69.84 -50.02 52.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-O 117.894 -1.051 . . . . 0.0 110.262 -172.503 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.451 1.2 p90 -76.52 -37.93 55.94 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 120.166 1.348 . . . . 0.0 113.381 -178.573 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -81.29 67.4 7.21 Favored 'General case' 0 N--CA 1.463 0.203 0 O-C-N 121.102 -0.999 . . . . 0.0 108.692 173.158 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -41.54 -42.03 2.29 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.259 1.424 . . . . 0.0 111.464 179.303 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.5 -47.67 0.23 Allowed 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 126.192 1.797 . . . . 0.0 113.575 172.063 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 47.7 mt -56.1 -51.75 66.77 Favored 'General case' 0 N--CA 1.457 -0.082 0 C-N-CA 122.807 0.443 . . . . 0.0 110.832 178.431 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -63.55 -43.98 95.5 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 179.68 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.159 0 CA-C-O 117.257 -1.857 . . . . 0.0 110.466 169.838 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.473 0.676 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -71.57 78.22 0.8 Allowed 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 122.72 0.408 . . . . 0.0 110.533 -179.129 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.1 m -51.13 157.62 1.46 Allowed Pre-proline 0 CA--C 1.538 0.488 0 C-N-CA 125.031 1.332 . . . . 0.0 111.427 176.272 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_exo -46.45 -49.64 11.53 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 123.28 2.653 . . . . 0.0 112.929 -179.188 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.0 mt -58.54 -45.78 88.17 Favored 'General case' 0 C--O 1.225 -0.217 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 175.489 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -61.34 -43.26 99.16 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-N 118.3 0.5 . . . . 0.0 109.656 -177.658 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -60.71 -49.78 76.13 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.518 0.727 . . . . 0.0 110.573 176.413 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.47 -45.89 90.96 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.276 0.63 . . . . 0.0 111.388 -178.349 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 65.5 mt -53.78 -51.64 42.29 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 170.463 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.73 -48.84 17.59 Favored Glycine 0 CA--C 1.527 0.81 0 C-N-CA 124.733 1.159 . . . . 0.0 112.013 174.591 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.1 mt -55.51 -56.49 19.66 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 117.749 0.775 . . . . 0.0 111.062 174.875 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.23 -42.74 86.97 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 118.586 0.63 . . . . 0.0 111.451 -178.574 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 79.0 mt -58.24 -52.34 60.03 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 C-N-CA 123.578 0.751 . . . . 0.0 110.586 173.815 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.72 -50.65 59.7 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.069 -1.212 . . . . 0.0 110.069 -178.378 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 8.6 mm -52.94 -48.82 50.98 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 C-N-CA 123.306 0.642 . . . . 0.0 110.093 175.132 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -55.57 -59.01 5.43 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 120.71 0.291 . . . . 0.0 110.527 177.634 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 5.6 t-80 -55.36 -39.83 70.55 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 124.252 1.021 . . . . 0.0 111.061 -175.544 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -48.25 -34.49 10.39 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.653 0.781 . . . . 0.0 112.064 -178.37 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -107.16 -53.59 2.59 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.41 0.684 . . . . 0.0 109.793 178.1 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.8 m -60.68 -39.31 87.97 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.894 0.878 . . . . 0.0 112.267 -172.909 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.15 55.6 3.59 Favored Glycine 0 CA--C 1.526 0.724 0 C-N-CA 123.803 0.716 . . . . 0.0 112.066 -171.024 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.0 mtmp? -150.07 -45.17 0.13 Allowed 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 125.955 1.702 . . . . 0.0 110.614 -176.902 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -75.18 42.38 0.19 Allowed 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 114.373 1.249 . . . . 0.0 114.373 -169.133 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 69.57 -71.21 0.51 Allowed Glycine 0 CA--C 1.528 0.858 0 N-CA-C 110.623 -0.991 . . . . 0.0 110.623 -177.391 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 66.2 t0 -78.09 81.22 4.49 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 173.145 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.3 mtpp -46.9 -27.46 1.26 Allowed 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.472 1.509 . . . . 0.0 112.99 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 4.8 m80 -82.34 -5.18 58.43 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.62 1.568 . . . . 0.0 112.445 -171.469 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 6.9 p -126.91 164.5 21.31 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.753 1.221 . . . . 0.0 110.84 -178.694 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -154.44 174.63 14.62 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 124.342 1.057 . . . . 0.0 109.258 169.608 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.6 p -127.0 168.06 15.06 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.52 1.128 . . . . 0.0 112.831 -171.649 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.3 pttp -32.26 -61.34 0.26 Allowed 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 127.515 2.326 . . . . 0.0 113.921 177.47 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 20.5 tptp -54.66 -47.25 73.78 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 121.881 -0.512 . . . . 0.0 111.368 -179.27 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -61.81 -40.99 97.19 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 119.183 -0.437 . . . . 0.0 109.932 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 26.2 mt -63.13 -48.38 78.72 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 118.264 0.484 . . . . 0.0 111.437 176.535 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 9.1 mtpm? -61.93 -36.55 81.7 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.291 0.636 . . . . 0.0 110.966 179.193 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.58 -54.22 30.96 Favored 'General case' 0 C--O 1.224 -0.262 0 O-C-N 122.103 -0.373 . . . . 0.0 110.656 169.959 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.1 mt -43.77 -71.93 0.07 Allowed 'General case' 0 C--O 1.227 -0.108 0 C-N-CA 124.638 1.175 . . . . 0.0 110.29 178.288 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 12.9 tt -50.72 -50.66 22.26 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 CA-C-O 121.777 0.799 . . . . 0.0 110.212 -170.582 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -53.9 -47.13 71.45 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 126.324 1.85 . . . . 0.0 111.87 177.657 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.26 -55.37 5.78 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.944 0.498 . . . . 0.0 110.658 -175.668 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . 0.261 0.0 OUTLIER -91.27 -7.58 50.75 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 114.898 1.444 . . . . 0.0 114.898 -168.587 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 62.5 mt -118.18 81.49 1.68 Allowed 'General case' 0 C--O 1.231 0.109 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 167.893 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 57.9 p -76.47 61.85 1.79 Allowed 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 125.017 1.327 . . . . 0.0 108.667 179.33 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 66.2 mt -85.57 -58.8 3.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 C-N-CA 124.522 1.129 . . . . 0.0 108.06 -176.501 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.67 -67.63 1.61 Allowed Glycine 0 CA--C 1.528 0.848 0 N-CA-C 110.842 -0.903 . . . . 0.0 110.842 179.369 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 27.8 p -70.61 78.52 0.59 Allowed 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 169.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 42.7 mttp -54.91 95.87 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.758 1.223 . . . . 0.0 111.422 -172.27 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 57.1 mt -31.46 -53.94 0.24 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 127.6 2.36 . . . . 0.0 114.117 -172.542 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -153.46 169.85 22.17 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 106.53 -1.655 . . . . 0.0 106.53 175.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -40.15 -36.46 0.5 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 127.25 2.22 . . . . 0.0 113.009 -175.251 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -28.53 -57.53 0.13 Allowed 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 126.909 2.083 . . . . 0.0 113.89 178.025 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 63.4 tt0 -66.84 -40.99 88.15 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 121.075 0.464 . . . . 0.0 110.901 -173.714 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.608 HD12 ' H ' ' A' ' 53' ' ' ILE . 1.8 mp -64.8 -51.24 69.6 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 -179.776 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 82.8 t -55.68 -43.06 72.03 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 C-N-CA 123.964 0.906 . . . . 0.0 110.098 177.559 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.27 -52.2 66.69 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 119.583 1.083 . . . . 0.0 111.003 174.673 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 37.5 mt -53.36 -41.44 65.84 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 119.491 -0.29 . . . . 0.0 111.401 179.156 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.5 -62.4 1.42 Allowed 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.399 0.545 . . . . 0.0 110.139 176.43 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -43.53 -39.98 3.7 Favored 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 126.996 2.118 . . . . 0.0 111.572 -177.436 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -39.0 -49.7 1.72 Allowed 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 124.165 0.986 . . . . 0.0 112.261 173.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.4 mp -60.84 -48.37 82.12 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 -177.394 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -61.29 -54.0 49.58 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.095 0.558 . . . . 0.0 109.73 179.601 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.6 ttm180 -49.13 -44.95 42.96 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.599 1.16 . . . . 0.0 110.219 178.02 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 11.7 m-80 -80.69 19.43 0.83 Allowed 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 113.508 0.929 . . . . 0.0 113.508 -178.299 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.3 mtmp? -58.46 -32.99 69.25 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 120.004 1.274 . . . . 0.0 107.936 165.268 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -70.8 8.22 0.94 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.931 1.292 . . . . 0.0 113.24 171.932 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 71.74 -53.68 0.68 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 127.397 2.279 . . . . 0.0 112.877 178.898 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -125.11 168.98 12.63 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 125.213 1.405 . . . . 0.0 109.984 179.748 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.7 m -132.0 151.1 34.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 C-N-CA 125.791 1.636 . . . . 0.0 106.976 169.269 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -90.31 170.94 9.83 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 123.321 0.648 . . . . 0.0 111.037 175.253 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 73.6 t80 -34.51 -63.89 0.28 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.987 1.315 . . . . 0.0 113.123 171.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 50.3 tp60 -63.26 -32.34 73.73 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.768 1.167 . . . . 0.0 111.496 -173.064 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -68.45 -41.2 80.61 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 121.262 -0.899 . . . . 0.0 110.246 176.485 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -56.58 -50.54 71.64 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 170.994 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.6 mm -56.28 -38.3 54.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 O-C-N 121.848 -0.533 . . . . 0.0 110.087 176.463 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 90.4 m -66.63 -38.24 86.5 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 121.465 -0.772 . . . . 0.0 111.035 175.876 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -54.85 -54.49 41.68 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 172.759 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 53.8 mt -59.95 -40.89 90.56 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 111.763 0.283 . . . . 0.0 111.763 176.272 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.07 -47.05 91.8 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 110.895 -0.882 . . . . 0.0 110.895 -177.179 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.32 -45.21 81.09 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.37 0.668 . . . . 0.0 109.948 177.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 59.0 tp -49.53 -58.67 4.76 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.369 0.604 . . . . 0.0 109.983 173.573 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -48.59 -58.57 4.51 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 124.46 1.104 . . . . 0.0 110.294 176.006 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 56.5 ttm -50.89 -57.52 8.29 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 122.994 0.518 . . . . 0.0 110.883 -178.158 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 31.6 mt -61.04 -38.33 79.31 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 CA-C-O 117.937 -1.03 . . . . 0.0 110.91 -172.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.382 0.0 OUTLIER -97.05 7.65 46.19 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 115.229 1.566 . . . . 0.0 115.229 176.704 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -122.99 87.71 2.8 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 119.596 1.089 . . . . 0.0 109.883 169.229 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -38.48 -42.39 0.75 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 126.041 1.737 . . . . 0.0 113.796 176.173 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -45.93 -46.32 16.04 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.385 0.674 . . . . 0.0 111.625 176.571 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 91.6 mt -73.7 4.03 5.62 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.618 0.767 . . . . 0.0 112.97 -177.567 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -116.45 10.87 14.73 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.596 1.159 . . . . 0.0 110.145 170.462 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.245 0 CA-C-O 117.009 -1.995 . . . . 0.0 110.891 -179.757 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 72.3 mtp . . . . . 0 N--CA 1.476 0.839 0 N-CA-C 110.476 -0.194 . . . . 0.0 110.476 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.43 70.55 3.83 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-O 121.174 0.511 . . . . 0.0 110.112 176.737 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.4 m -56.17 164.17 1.99 Allowed Pre-proline 0 CA--C 1.54 0.558 0 C-N-CA 124.256 1.023 . . . . 0.0 111.339 174.646 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo -47.56 -50.52 11.29 Favored 'Trans proline' 0 N--CA 1.458 -0.602 0 C-N-CA 123.013 2.475 . . . . 0.0 112.72 177.632 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' B' ' 5' ' ' LEU . 1.7 mt -60.52 -39.68 88.66 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-O 118.887 -0.578 . . . . 0.0 112.423 174.889 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -61.11 -45.88 92.86 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 119.291 0.951 . . . . 0.0 109.152 -179.304 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.9 tp60 -63.81 -43.92 94.81 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.717 -0.22 . . . . 0.0 111.081 177.106 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.31 -46.76 75.8 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.741 -0.599 . . . . 0.0 111.408 -177.42 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 76.7 mt -55.3 -52.16 48.53 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 170.268 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -45.19 -47.33 10.56 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 124.897 1.237 . . . . 0.0 111.906 174.803 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.5 mt -56.36 -59.01 5.58 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.442 0.697 . . . . 0.0 110.518 173.654 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.6 mp -57.25 -42.35 81.37 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 119.496 1.044 . . . . 0.0 112.061 -177.631 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 55.9 mt -58.77 -56.82 14.23 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 123.953 0.901 . . . . 0.0 110.439 174.168 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.06 -49.14 69.06 Favored Glycine 0 CA--C 1.522 0.513 0 N-CA-C 110.193 -1.163 . . . . 0.0 110.193 -176.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 8.5 mm -50.48 -53.51 12.26 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 C-N-CA 124.393 1.077 . . . . 0.0 109.99 174.138 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -52.64 -62.98 1.3 Allowed 'General case' 0 CA--C 1.528 0.117 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 177.079 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -51.03 -39.52 56.08 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.92 0.888 . . . . 0.0 111.745 -175.066 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -52.22 -34.82 47.38 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.969 0.907 . . . . 0.0 111.982 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 94.6 m-85 -111.42 -35.61 5.77 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 118.3 0.5 . . . . 0.0 112.18 -177.098 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.6 m -64.91 -37.41 87.54 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 119.028 0.831 . . . . 0.0 111.003 174.701 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.52 58.79 2.47 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 124.099 0.857 . . . . 0.0 112.984 -174.073 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 22.1 pttm -161.41 -37.25 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.845 1.258 . . . . 0.0 111.577 171.979 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -112.49 148.04 35.27 Favored 'General case' 0 C--N 1.339 0.15 0 C-N-CA 123.426 0.69 . . . . 0.0 111.497 -175.339 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 54.61 -145.61 27.87 Favored Glycine 0 CA--C 1.528 0.877 0 C-N-CA 124.452 1.025 . . . . 0.0 113.676 169.239 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -80.23 103.12 9.88 Favored 'General case' 0 C--O 1.223 -0.309 0 N-CA-C 106.99 -1.485 . . . . 0.0 106.99 175.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 40.7 mmtm -45.04 -35.4 2.96 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 116.324 1.972 . . . . 0.0 116.324 -168.084 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 38.8 p-80 -79.71 8.57 6.39 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 120.061 1.3 . . . . 0.0 113.798 177.129 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 17.0 p -135.72 171.93 13.75 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 126.79 2.036 . . . . 0.0 106.352 174.684 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.91 168.58 24.33 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 118.756 0.707 . . . . 0.0 110.485 173.836 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.4 t -116.25 -178.57 3.44 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.341 1.056 . . . . 0.0 112.256 -175.835 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 55.0 mttm -35.68 -66.61 0.19 Allowed 'General case' 0 C--O 1.234 0.285 0 C-N-CA 128.312 2.645 . . . . 0.0 113.235 -169.618 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 22.5 ttpp -50.82 -43.43 58.95 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.304 1.042 . . . . 0.0 110.589 -174.9 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -64.68 -35.61 81.6 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-O 118.723 -0.656 . . . . 0.0 111.602 -177.613 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -68.79 -51.38 41.57 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 119.502 1.047 . . . . 0.0 109.43 176.063 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -57.52 -42.35 82.68 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 120.996 0.427 . . . . 0.0 109.965 -178.482 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 55.9 tt0 -55.88 -65.66 0.56 Allowed 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 123.998 0.919 . . . . 0.0 109.233 169.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 4.9 mt -37.66 -60.65 0.69 Allowed 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 124.864 1.265 . . . . 0.0 112.003 179.811 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 18.3 tt -61.12 -48.53 88.59 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 -176.808 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 -56.5 -50.47 71.69 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.807 0.73 . . . . 0.0 112.063 179.284 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -70.35 -50.98 33.36 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.231 0.612 . . . . 0.0 110.695 -174.123 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -96.38 -17.83 20.36 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 -167.309 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 45.3 mt -113.91 70.95 0.74 Allowed 'General case' 0 CA--C 1.526 0.039 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 169.883 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 20.7 p -60.09 -40.53 89.9 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.484 171.727 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . 0.27 2.2 tt 65.21 -44.3 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 129.391 3.076 . . . . 0.0 116.504 169.224 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 114.95 -137.06 13.66 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 107.003 -2.439 . . . . 0.0 107.003 -169.387 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 4.0 m -76.65 54.79 0.99 Allowed 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 117.82 0.81 . . . . 0.0 113.096 -173.802 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 47' ' ' LYS . . . . . 0.606 ' HB3' HD11 ' B' ' 53' ' ' ILE . 33.9 mtmm 41.38 67.32 0.56 Allowed 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.418 1.487 . . . . 0.0 111.37 178.535 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 16.1 mt -62.38 86.46 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.948 0.899 . . . . 0.0 112.741 -169.32 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 83.5 150.09 0.08 Allowed 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 127.445 2.298 . . . . 0.0 110.611 173.817 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -45.68 -36.85 5.2 Favored 'General case' 0 C--O 1.225 -0.227 0 C-N-CA 126.303 1.841 . . . . 0.0 113.511 -170.24 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.93 -60.24 0.17 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 126.108 1.763 . . . . 0.0 113.909 -179.317 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -63.57 -44.19 94.82 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.553 0.741 . . . . 0.0 110.843 -174.756 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 53' ' ' ILE . . . . . 0.636 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.4 mp -62.06 -52.38 61.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 -177.916 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 75.6 t -53.86 -53.6 25.85 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 C-N-CA 123.961 0.905 . . . . 0.0 109.319 177.686 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -47.28 -52.5 16.01 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 118.698 0.681 . . . . 0.0 111.81 178.605 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 16.7 mt -50.57 -39.32 49.18 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 119.269 -0.396 . . . . 0.0 111.923 178.479 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 8.7 mmt -81.0 -64.72 1.13 Allowed 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 118.458 0.572 . . . . 0.0 109.737 178.539 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -34.82 -43.8 0.2 Allowed 'General case' 0 CA--C 1.523 -0.067 0 C-N-CA 128.046 2.538 . . . . 0.0 112.069 178.763 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -37.41 -50.95 1.1 Allowed 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.61 1.164 . . . . 0.0 112.577 176.067 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.8 pp -60.49 -33.13 72.16 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -173.987 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -83.54 -45.65 13.32 Favored 'General case' 0 N--CA 1.456 -0.125 0 C-N-CA 123.516 0.727 . . . . 0.0 109.746 176.764 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 52.8 ttt-85 -58.16 -37.14 74.11 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 122.178 -0.326 . . . . 0.0 110.955 -176.9 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -75.04 36.78 0.11 Allowed 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.478 -0.764 . . . . 0.0 112.357 177.766 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 63.6 mttt -63.02 -28.27 69.98 Favored 'General case' 0 CA--C 1.533 0.304 0 O-C-N 120.581 -1.324 . . . . 0.0 109.148 168.132 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -61.63 -13.32 21.29 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.104 0.961 . . . . 0.0 112.527 169.681 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 70.42 -63.53 0.4 Allowed 'General case' 0 C--N 1.342 0.247 0 C-N-CA 126.733 2.013 . . . . 0.0 110.649 -174.671 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -104.59 108.55 20.05 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.864 1.266 . . . . 0.0 107.642 172.677 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 28.4 m -79.58 136.08 24.31 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 N-CA-C 107.829 -1.175 . . . . 0.0 107.829 169.75 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 1.1 p30 -80.65 171.47 14.98 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.774 0.321 . . . . 0.0 111.186 176.682 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 55.9 t80 -38.12 -61.92 0.62 Allowed 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.401 1.08 . . . . 0.0 112.97 174.023 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 10.2 tp-100 -63.98 -32.52 74.09 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 120.391 1.45 . . . . 0.0 111.694 -175.738 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -64.52 -41.72 96.21 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 119.623 1.101 . . . . 0.0 110.162 175.15 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -57.95 -48.67 79.26 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.794 -0.566 . . . . 0.0 109.796 171.572 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 19.7 mm -60.83 -27.77 41.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 O-C-N 121.532 -0.73 . . . . 0.0 110.745 176.876 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 42.5 m -73.34 -38.69 65.67 Favored 'General case' 0 C--O 1.226 -0.181 0 O-C-N 121.076 -1.015 . . . . 0.0 110.171 172.883 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 36.6 t80 -54.33 -54.76 36.01 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 171.175 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 32.8 mt -59.9 -47.65 84.88 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 177.218 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.69 -39.83 97.93 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 111.021 -0.831 . . . . 0.0 111.021 -174.501 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.69 -47.85 57.74 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 123.882 0.873 . . . . 0.0 110.22 176.674 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -47.58 -53.74 13.72 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 123.933 0.893 . . . . 0.0 109.565 173.034 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -55.12 -56.31 21.25 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 124.259 1.024 . . . . 0.0 110.365 174.934 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 51.5 ttm -50.55 -42.95 55.96 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.516 0.598 . . . . 0.0 111.763 -178.872 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 42.8 mt -67.88 -58.39 6.24 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.442 0 CA-C-O 118.385 -0.817 . . . . 0.0 110.644 -179.627 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.364 1.0 OUTLIER -77.42 -38.39 49.79 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 119.94 1.246 . . . . 0.0 113.385 -174.674 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -78.75 64.86 3.84 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 170.295 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 60.0 mt-10 -46.91 -31.29 3.03 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 125.702 1.601 . . . . 0.0 112.802 -174.082 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -45.48 -36.92 4.79 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.06 0.944 . . . . 0.0 112.767 175.041 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 83.8 mt -62.95 -27.04 69.12 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 178.267 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -85.34 -48.61 8.88 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 118.539 0.609 . . . . 0.0 109.379 169.927 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.159 0 CA-C-O 117.534 -1.703 . . . . 0.0 110.086 -179.144 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 tmt? . . . . . 0 N--CA 1.474 0.736 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.58 73.09 4.15 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 122.744 0.418 . . . . 0.0 111.214 -174.45 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 2.7 m -54.51 161.71 1.99 Allowed Pre-proline 0 CA--C 1.538 0.518 0 C-N-CA 123.829 0.852 . . . . 0.0 111.193 173.213 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_exo -45.57 -49.08 11.08 Favored 'Trans proline' 0 N--CA 1.46 -0.453 0 C-N-CA 123.519 2.813 . . . . 0.0 113.573 -179.39 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.8 mt -55.62 -52.93 62.12 Favored 'General case' 0 C--O 1.226 -0.168 0 N-CA-C 111.769 0.285 . . . . 0.0 111.769 174.328 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -60.24 -41.44 93.14 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 -175.374 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.0 tp-100 -60.98 -51.08 70.76 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.57 0.748 . . . . 0.0 110.493 176.778 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.99 -45.81 93.31 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.338 0.655 . . . . 0.0 111.146 -178.77 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 67.2 mt -53.59 -52.16 36.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 170.518 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.69 -47.74 23.88 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 125.369 1.462 . . . . 0.0 111.601 175.718 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 mt -55.98 -54.59 42.96 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 117.726 0.763 . . . . 0.0 110.995 174.443 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.99 -43.93 91.53 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 118.87 0.759 . . . . 0.0 111.558 -179.299 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 96.2 mt -58.05 -49.29 81.9 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 123.007 0.523 . . . . 0.0 110.173 173.546 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.75 -51.54 54.4 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 110.102 -1.199 . . . . 0.0 110.102 -178.718 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 8.2 mm -54.81 -49.35 70.05 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 123.273 0.629 . . . . 0.0 109.745 175.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' PHE . . . . . 0.401 ' HB2' ' CE2' ' A' ' 73' ' ' TYR . 32.2 t80 -53.48 -55.67 23.36 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 121.479 0.657 . . . . 0.0 110.985 178.077 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 74.2 t60 -64.79 -32.39 74.05 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.346 -175.229 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -53.11 -49.65 66.07 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.882 0.764 . . . . 0.0 110.712 176.723 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -89.96 -36.04 15.21 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 122.323 -0.236 . . . . 0.0 111.321 -175.297 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.3 t -63.62 -31.64 72.87 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.775 -0.578 . . . . 0.0 110.641 173.555 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -39.88 -37.19 0.92 Allowed Glycine 0 CA--C 1.525 0.701 0 C-N-CA 128.296 2.855 . . . . 0.0 115.334 -176.025 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -77.84 -20.33 53.3 Favored 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 -176.282 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -82.23 173.45 12.08 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.486 0.714 . . . . 0.0 110.43 -176.407 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -65.86 -60.63 6.29 Favored Glycine 0 CA--C 1.53 0.989 0 N-CA-C 110.411 -1.075 . . . . 0.0 110.411 178.167 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -84.84 90.51 7.79 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 176.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 59.9 mttm -76.1 37.24 0.15 Allowed 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.517 1.127 . . . . 0.0 113.568 -169.63 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 4.6 p80 -150.63 38.44 0.69 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 126.214 1.805 . . . . 0.0 108.562 172.337 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -161.41 141.58 10.7 Favored 'General case' 0 N--CA 1.455 -0.206 0 N-CA-C 105.694 -1.965 . . . . 0.0 105.694 -177.323 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -160.01 174.82 13.78 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 119.008 0.822 . . . . 0.0 110.661 -176.79 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 59.6 p -124.57 174.38 7.86 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 118.808 0.731 . . . . 0.0 112.579 -170.025 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -27.39 -53.47 0.08 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 128.348 2.659 . . . . 0.0 114.016 169.664 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.07 -54.77 40.98 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.805 0.842 . . . . 0.0 109.713 179.724 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 -66.11 -34.34 77.83 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 118.642 -0.694 . . . . 0.0 110.527 -177.881 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 60.2 mt -65.13 -50.06 67.51 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.317 0.962 . . . . 0.0 110.999 177.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 40.7 mttp -57.19 -49.16 76.83 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 174.657 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -53.09 -54.73 31.26 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.644 0.778 . . . . 0.0 110.302 177.006 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.6 mt -48.42 -65.29 0.59 Allowed 'General case' 0 CA--C 1.52 -0.196 0 C-N-CA 126.099 1.759 . . . . 0.0 110.171 177.4 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 16.9 tt -59.89 -44.76 95.03 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.275 0 N-CA-C 109.543 -0.539 . . . . 0.0 109.543 -171.442 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -60.16 -53.51 56.93 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 179.364 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -67.82 -49.19 63.58 Favored 'General case' 0 C--O 1.227 -0.083 0 O-C-N 121.825 -0.547 . . . . 0.0 109.576 -174.133 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -74.63 -65.05 0.91 Allowed 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -175.767 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 89.3 mt -88.42 67.26 8.57 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 -178.068 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 38.8 p -47.99 -65.04 0.63 Allowed 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 124.366 1.066 . . . . 0.0 109.838 177.156 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 48.8 mt 64.8 -64.39 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 C-N-CA 127.205 2.202 . . . . 0.0 111.978 173.695 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.36 -66.09 1.97 Allowed Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.066 -1.214 . . . . 0.0 110.066 -178.932 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 21.0 m -68.29 75.54 0.24 Allowed 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 124.373 1.069 . . . . 0.0 109.223 170.612 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 23.4 mmtp -47.45 93.89 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 126.032 1.733 . . . . 0.0 110.825 -179.82 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 87.9 mt -46.31 -54.55 8.73 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 125.637 1.575 . . . . 0.0 112.982 -169.542 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -166.72 162.07 16.02 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 106.158 -1.793 . . . . 0.0 106.158 -169.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -38.09 -40.8 0.52 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 126.643 1.977 . . . . 0.0 114.773 -171.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.86 -59.56 0.17 Allowed 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.796 1.639 . . . . 0.0 114.66 -178.237 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 17.6 tt0 -65.57 -40.27 92.58 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-O 121.13 0.491 . . . . 0.0 111.214 -174.265 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.643 HD12 ' H ' ' A' ' 53' ' ' ILE . 2.2 mp -63.83 -51.86 64.36 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 69.2 t -55.13 -43.7 71.34 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 C-N-CA 124.401 1.081 . . . . 0.0 110.348 178.466 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.34 -54.41 45.78 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 119.205 0.911 . . . . 0.0 110.454 173.89 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 57.5 mt -54.18 -40.02 67.15 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 119.267 -0.397 . . . . 0.0 111.2 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 25.3 mmt -68.62 -65.01 0.75 Allowed 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.549 0.613 . . . . 0.0 109.711 175.785 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -40.69 -40.46 1.31 Allowed 'General case' 0 N--CA 1.462 0.171 0 C-N-CA 128.077 2.551 . . . . 0.0 111.886 -177.572 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -38.43 -48.55 1.38 Allowed 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 124.479 1.112 . . . . 0.0 111.876 175.284 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -61.33 -38.29 86.37 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 118.393 0.542 . . . . 0.0 111.838 -176.551 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -76.15 -51.19 12.68 Favored 'General case' 0 N--CA 1.457 -0.106 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 16.9 ttm180 -48.51 -46.85 38.98 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 123.571 0.748 . . . . 0.0 109.926 177.215 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -86.23 29.06 0.77 Allowed 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -177.321 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 20.0 pttp -57.46 -35.73 70.51 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.157 -0.965 . . . . 0.0 108.84 166.683 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -74.29 3.7 6.9 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.938 1.295 . . . . 0.0 112.623 173.644 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 79.1 mm-40 68.72 -63.61 0.35 Allowed 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 127.017 2.127 . . . . 0.0 112.054 -178.211 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -97.63 162.06 13.47 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.983 0.913 . . . . 0.0 109.844 177.111 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.4 m -137.38 149.65 25.79 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 C-N-CA 126.044 1.738 . . . . 0.0 108.079 174.331 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -89.49 175.71 7.19 Favored 'General case' 0 C--N 1.339 0.142 0 C-N-CA 124.285 1.034 . . . . 0.0 111.108 176.989 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -39.46 -64.74 0.44 Allowed 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 125.275 1.43 . . . . 0.0 112.967 174.483 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 11.0 tp-100 -65.03 -32.22 73.83 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 120.242 1.383 . . . . 0.0 111.807 -172.578 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -65.22 -44.47 88.15 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 119.033 0.833 . . . . 0.0 110.419 175.648 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' TYR . . . . . 0.401 ' CE2' ' HB2' ' A' ' 16' ' ' PHE . 0.7 OUTLIER -55.92 -54.31 46.28 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 172.279 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 20.7 mm -52.06 -46.37 42.63 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.312 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 178.419 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 92.9 m -59.35 -27.8 66.26 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 123.464 0.706 . . . . 0.0 111.795 179.084 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 11.4 t80 -59.69 -52.13 66.84 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 119.464 1.029 . . . . 0.0 108.436 172.166 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 56.2 mt -67.26 -40.05 86.15 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.853 0.861 . . . . 0.0 111.699 -179.538 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.51 -45.12 69.38 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.135 -1.186 . . . . 0.0 110.135 -178.045 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.02 -48.58 81.13 Favored 'General case' 0 N--CA 1.451 -0.387 0 O-C-N 122.279 -0.541 . . . . 0.0 109.796 173.246 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 22.5 tp -50.44 -57.03 8.97 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.407 0.622 . . . . 0.0 109.807 176.867 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.1 -55.04 16.57 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 124.56 1.144 . . . . 0.0 110.247 177.294 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 7.7 ttp -59.82 -45.07 93.53 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 122.925 0.49 . . . . 0.0 111.516 -175.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 93.0 mt -64.63 -52.94 48.4 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 CA-C-O 117.995 -1.002 . . . . 0.0 110.281 -177.874 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.445 0.0 OUTLIER -79.3 -34.06 42.73 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 120.034 1.288 . . . . 0.0 113.887 -176.121 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -80.1 72.93 6.92 Favored 'General case' 0 N--CA 1.462 0.164 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 169.403 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -47.79 -30.48 4.01 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.956 1.302 . . . . 0.0 113.097 -171.756 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -38.79 -47.02 1.34 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.959 1.304 . . . . 0.0 112.39 169.817 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.4 mt -72.49 6.54 2.31 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -177.241 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -106.61 8.22 31.09 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 119.507 1.049 . . . . 0.0 109.908 167.386 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.116 0 CA-C-O 117.384 -1.787 . . . . 0.0 108.846 171.573 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 61.9 ttp . . . . . 0 N--CA 1.474 0.754 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -79.25 63.2 3.82 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 121.249 0.547 . . . . 0.0 110.378 176.772 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 2.5 m -59.63 166.41 3.33 Favored Pre-proline 0 CA--C 1.539 0.549 0 C-N-CA 125.134 1.374 . . . . 0.0 111.202 178.831 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_exo -45.75 -47.26 14.05 Favored 'Trans proline' 0 N--CA 1.459 -0.5 0 C-N-CA 123.257 2.638 . . . . 0.0 112.927 177.652 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.428 HD23 ' HA ' ' B' ' 5' ' ' LEU . 6.2 mt -56.67 -49.23 75.69 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 119.329 -0.367 . . . . 0.0 111.514 174.249 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -58.21 -46.74 85.31 Favored 'General case' 0 N--CA 1.457 -0.124 0 CA-C-N 118.488 0.585 . . . . 0.0 109.853 -178.402 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 -57.54 -51.0 71.25 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 122.759 0.424 . . . . 0.0 110.575 177.226 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.5 -45.7 82.55 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.49 0.716 . . . . 0.0 111.867 -175.523 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 81.7 mt -55.88 -50.08 70.97 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 172.002 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.37 -50.39 17.84 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 124.886 1.231 . . . . 0.0 111.5 173.745 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.1 mt -54.24 -57.59 10.59 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 117.474 0.637 . . . . 0.0 110.702 174.223 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 9.9 mp -57.42 -43.44 83.82 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 119.391 0.996 . . . . 0.0 112.032 -177.597 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 85.8 mt -56.97 -58.03 7.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 C-N-CA 123.171 0.588 . . . . 0.0 110.12 173.711 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.25 -49.5 67.86 Favored Glycine 0 CA--C 1.524 0.605 0 N-CA-C 110.553 -1.019 . . . . 0.0 110.553 -175.269 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.3 mm -49.68 -50.99 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 C-N-CA 124.139 0.976 . . . . 0.0 109.935 173.749 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 56.4 t80 -57.46 -58.94 6.1 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 121.042 0.449 . . . . 0.0 110.008 178.05 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 7.1 t-80 -51.55 -36.98 47.43 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.051 0.94 . . . . 0.0 111.626 -176.513 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -51.56 -34.04 34.97 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.298 1.039 . . . . 0.0 112.474 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -111.61 -47.41 3.16 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 118.6 0.636 . . . . 0.0 110.688 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.2 m -72.42 -42.65 64.87 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.266 0.626 . . . . 0.0 111.963 -176.398 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -80.41 66.36 3.68 Favored Glycine 0 N--CA 1.446 -0.646 0 CA-C-N 116.097 -0.501 . . . . 0.0 112.177 -167.749 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 5.9 mtmp? -89.04 -61.82 1.62 Allowed 'General case' 0 N--CA 1.445 -0.678 0 C-N-CA 123.858 0.863 . . . . 0.0 109.108 -178.23 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -169.02 168.99 9.83 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 125.612 1.565 . . . . 0.0 106.937 179.207 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 52.89 -106.56 0.41 Allowed Glycine 0 CA--C 1.528 0.871 0 C-N-CA 123.687 0.661 . . . . 0.0 112.053 174.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -79.98 55.94 2.25 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.178 0.991 . . . . 0.0 110.906 -175.454 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 38.9 mtmt -53.87 -27.96 33.27 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.902 0.881 . . . . 0.0 112.662 -177.947 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -78.33 6.52 8.15 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 114.109 1.152 . . . . 0.0 114.109 -175.328 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -138.85 151.91 47.38 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.078 1.351 . . . . 0.0 109.474 -170.201 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -156.09 166.38 33.62 Favored 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 123.26 0.624 . . . . 0.0 110.779 174.031 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 67.9 m -111.76 174.68 5.76 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.145 1.378 . . . . 0.0 112.818 -176.197 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -37.81 -55.38 1.19 Allowed 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 126.913 2.085 . . . . 0.0 114.545 -177.683 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -53.56 -48.51 69.08 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 -176.725 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -61.14 -38.65 87.16 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 123.041 0.536 . . . . 0.0 111.324 179.133 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 85.0 mt -63.27 -49.33 74.48 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 119.214 0.916 . . . . 0.0 111.038 175.722 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -57.56 -47.17 82.79 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 177.882 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -58.17 -47.41 83.49 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-O 119.024 -0.512 . . . . 0.0 110.791 175.232 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 8.9 mt -50.76 -53.58 30.56 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 119.655 1.116 . . . . 0.0 110.176 178.242 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 35.9 mt -56.78 -60.34 2.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.212 175.558 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 21.1 tt0 -53.07 -48.98 67.3 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.621 -0.674 . . . . 0.0 112.496 -173.476 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 9.5 mmpt? -79.53 -48.97 12.96 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 125.564 1.546 . . . . 0.0 110.551 -171.178 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 28.2 mm-40 -101.89 -12.42 18.26 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 -168.435 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 57.2 mt -116.33 72.33 0.81 Allowed 'General case' 0 C--O 1.231 0.102 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 169.559 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 73.4 p -77.9 49.97 0.82 Allowed 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 125.218 1.407 . . . . 0.0 109.414 178.191 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 36.3 mt -66.15 -43.45 92.07 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 C-N-CA 123.277 0.631 . . . . 0.0 109.71 -170.693 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.73 -65.98 1.75 Allowed Glycine 0 CA--C 1.528 0.892 0 N-CA-C 110.265 -1.134 . . . . 0.0 110.265 -176.895 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 17.7 m -68.45 72.55 0.21 Allowed 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 125.269 1.428 . . . . 0.0 110.327 174.592 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 47' ' ' LYS . . . . . 0.418 ' HB3' HD11 ' B' ' 53' ' ' ILE . 30.9 mmtm -40.9 90.5 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 127.617 2.367 . . . . 0.0 112.665 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 86.1 mt -67.08 111.34 3.82 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.058 0.943 . . . . 0.0 112.667 -170.491 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 68.44 -69.28 0.15 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.154 1.781 . . . . 0.0 113.9 166.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 18.3 p-10 -178.33 -42.3 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 125.55 1.54 . . . . 0.0 110.282 -170.471 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.84 -63.57 0.13 Allowed 'General case' 0 C--O 1.226 -0.142 0 C-N-CA 126.198 1.799 . . . . 0.0 114.133 -174.242 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -66.17 -37.54 85.89 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 122.747 0.419 . . . . 0.0 111.32 -172.719 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 53' ' ' ILE . . . . . 0.634 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.4 mp -62.28 -52.76 56.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 N-CA-C 106.076 -1.824 . . . . 0.0 106.076 177.841 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 71.9 t -54.04 -40.87 47.68 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 C-N-CA 124.23 1.012 . . . . 0.0 110.41 176.912 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 12.8 mmmt -60.94 -51.22 70.21 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 120.187 1.358 . . . . 0.0 110.484 175.915 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 76.3 mt -56.96 -36.41 70.26 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 119.148 -0.454 . . . . 0.0 110.906 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 25.2 mmt -70.26 -62.49 1.37 Allowed 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 118.739 0.699 . . . . 0.0 109.808 173.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -46.61 -30.47 2.31 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 128.132 2.573 . . . . 0.0 112.405 -176.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -38.29 -48.17 1.28 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.508 1.123 . . . . 0.0 111.268 169.181 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.9 pp -58.52 -34.32 70.83 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 121.144 -0.972 . . . . 0.0 112.167 -178.764 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -78.42 -55.95 4.82 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 178.866 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 16.5 mmt180 -42.11 -50.35 4.75 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 124.972 1.309 . . . . 0.0 110.646 176.371 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 25.5 m120 -94.81 25.02 4.3 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 123.971 0.908 . . . . 0.0 111.849 -171.456 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 7.4 mtmp? -55.92 -39.1 71.17 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 119.639 1.109 . . . . 0.0 109.355 168.152 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -80.5 13.02 2.67 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.931 0.892 . . . . 0.0 112.121 175.512 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 65.68 -68.03 0.13 Allowed 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 126.581 1.953 . . . . 0.0 111.43 -172.47 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -87.89 154.83 20.22 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 125.149 1.38 . . . . 0.0 111.309 -172.74 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 34.9 m -132.58 147.6 31.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 N-CA-C 105.618 -1.993 . . . . 0.0 105.618 165.713 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 20.2 p30 -89.24 171.6 9.67 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 123.556 0.742 . . . . 0.0 110.884 176.746 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -39.97 -60.85 0.95 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.568 1.147 . . . . 0.0 113.16 175.186 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -64.56 -35.99 82.78 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 120.314 1.416 . . . . 0.0 111.362 -174.167 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.77 -40.27 96.27 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.561 -0.712 . . . . 0.0 110.578 175.194 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -57.2 -49.68 75.25 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 118.571 0.623 . . . . 0.0 109.964 169.653 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 24.6 mm -58.62 -28.14 36.05 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 O-C-N 121.384 -0.822 . . . . 0.0 110.709 176.779 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 30.1 m -80.25 -23.48 40.79 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.231 1.012 . . . . 0.0 111.786 173.366 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -67.56 -53.48 28.0 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 107.673 -1.232 . . . . 0.0 107.673 169.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 40.9 mt -57.65 -41.65 81.91 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 120.908 0.385 . . . . 0.0 110.668 171.661 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.76 -53.1 46.53 Favored Glycine 0 CA--C 1.523 0.577 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 179.329 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.75 -47.31 85.8 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 122.83 0.452 . . . . 0.0 110.641 178.218 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 11.3 tp -48.06 -60.54 2.54 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.978 0.894 . . . . 0.0 110.082 175.155 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.85 -56.64 12.78 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 125.31 1.444 . . . . 0.0 110.294 -179.825 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 56.6 ttm -56.26 -43.42 78.71 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.737 0.815 . . . . 0.0 110.989 -178.321 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 96.4 mt -67.9 -55.74 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-O 118.415 -0.802 . . . . 0.0 109.533 -175.613 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.4 0.4 OUTLIER -73.13 -33.63 65.64 Favored 'General case' 0 C--N 1.344 0.356 0 C-N-CA 118.325 -1.35 . . . . 0.0 112.803 -175.982 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -81.14 64.98 6.1 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 169.071 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -42.22 -37.96 1.63 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.138 1.375 . . . . 0.0 112.747 -176.861 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.69 -54.0 0.44 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 126.093 1.757 . . . . 0.0 112.65 169.649 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 61.7 mt -63.49 -17.79 63.11 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -173.285 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -68.02 -27.97 67.0 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.676 0.671 . . . . 0.0 110.91 174.341 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.169 0 CA-C-O 117.167 -1.907 . . . . 0.0 110.921 -169.912 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.5 mtm . . . . . 0 N--CA 1.476 0.835 0 CA-C-O 120.25 0.071 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -75.77 71.03 2.6 Favored 'General case' 0 CA--C 1.529 0.137 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 173.213 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.4 m -56.01 163.79 2.07 Favored Pre-proline 0 CA--C 1.54 0.593 0 C-N-CA 124.204 1.002 . . . . 0.0 111.352 177.049 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -46.62 -49.02 12.71 Favored 'Trans proline' 0 N--CA 1.459 -0.528 0 C-N-CA 123.255 2.637 . . . . 0.0 112.831 178.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.2 mt -58.64 -46.39 87.22 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-O 119.193 -0.432 . . . . 0.0 111.543 175.891 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -56.97 -48.18 79.0 Favored 'General case' 0 C--O 1.227 -0.131 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 -179.025 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.3 tp60 -62.81 -44.44 96.14 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.275 179.146 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.4 -46.17 81.08 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 121.355 0.598 . . . . 0.0 111.328 -178.181 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 72.4 mt -54.55 -50.86 55.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 170.532 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.51 -48.98 16.48 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 124.646 1.117 . . . . 0.0 111.729 173.983 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 mt -55.36 -55.34 32.71 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 117.767 0.784 . . . . 0.0 110.945 174.409 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -58.91 -45.2 90.9 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 119.012 0.824 . . . . 0.0 111.839 -178.04 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.415 HD11 ' HB1' ' B' ' 81' ' ' ALA . 90.5 mt -59.5 -50.98 77.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 C-N-CA 122.857 0.463 . . . . 0.0 110.354 175.073 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -53.59 -54.07 32.3 Favored Glycine 0 CA--C 1.523 0.539 0 N-CA-C 109.763 -1.335 . . . . 0.0 109.763 -179.409 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 6.8 mm -50.53 -51.7 18.24 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 C-N-CA 124.079 0.952 . . . . 0.0 110.12 174.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -51.51 -57.25 9.57 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 118.022 0.374 . . . . 0.0 110.594 178.454 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' HIS . . . . . 0.416 ' HA ' ' H ' ' A' ' 21' ' ' GLY . 6.5 m-70 -70.3 -21.7 62.91 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 -174.756 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.8 ttpp -57.93 -18.57 24.09 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 119.034 -0.508 . . . . 0.0 111.342 169.701 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -115.92 -67.72 0.97 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.743 0.817 . . . . 0.0 110.273 171.565 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 30.9 p -51.03 -65.92 0.47 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.714 0.769 . . . . 0.0 111.158 -173.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLY . . . . . 0.416 ' H ' ' HA ' ' A' ' 17' ' ' HIS . . . -34.19 -56.32 0.71 Allowed Glycine 0 CA--C 1.52 0.406 0 C-N-CA 128.465 2.936 . . . . 0.0 112.089 178.151 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -77.43 -37.92 50.67 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -177.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -76.78 48.11 0.55 Allowed 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 119.284 0.947 . . . . 0.0 112.492 -176.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 73.4 -67.12 1.55 Allowed Glycine 0 CA--C 1.529 0.966 0 O-C-N 121.299 -0.876 . . . . 0.0 113.558 169.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -80.15 57.74 2.8 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.298 1.039 . . . . 0.0 110.922 -171.859 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 28.8 mttp -35.41 -42.55 0.21 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 128.03 2.532 . . . . 0.0 117.453 -167.798 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 16.1 m170 -84.03 -7.65 59.34 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.848 0.859 . . . . 0.0 112.748 -174.103 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.3 p -138.35 173.39 11.66 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 126.876 2.071 . . . . 0.0 109.585 -168.216 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.7 pp -160.2 -173.86 4.24 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 169.384 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 77.8 p -129.95 172.84 11.28 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 119.697 1.135 . . . . 0.0 112.568 -179.582 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.7 ptmm? -31.69 -51.06 0.21 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 126.107 1.763 . . . . 0.0 113.512 169.491 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.7 ttpt -60.87 -47.53 85.98 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -177.241 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.0 mp0 -66.55 -35.44 80.23 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 118.428 -0.796 . . . . 0.0 110.559 179.804 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 73.7 mt -61.52 -51.38 68.85 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.779 1.172 . . . . 0.0 111.032 174.621 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.0 mtpp -60.11 -45.12 94.03 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 120.841 0.353 . . . . 0.0 110.279 179.545 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -54.52 -54.93 34.58 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.112 0.965 . . . . 0.0 110.521 173.661 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.0 mt -49.02 -61.19 2.2 Favored 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 125.382 1.473 . . . . 0.0 110.033 178.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 20.2 tt -59.71 -48.74 86.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 C-N-CA 119.872 -0.731 . . . . 0.0 109.724 -176.377 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 -54.88 -50.11 69.54 Favored 'General case' 0 CA--C 1.539 0.528 0 O-C-N 121.88 -0.512 . . . . 0.0 112.208 -178.579 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.7 -54.21 7.32 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 121.908 -0.495 . . . . 0.0 110.714 -176.862 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 49.8 mm-40 -82.4 -21.81 35.64 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 -167.382 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 23.0 mt -117.78 79.21 1.33 Allowed 'General case' 0 C--O 1.227 -0.086 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 174.437 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 34.1 p -65.98 -64.85 0.77 Allowed 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 -178.261 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . 0.26 45.6 mt 66.06 -60.53 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 126.695 1.998 . . . . 0.0 113.015 174.405 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.08 -67.07 1.79 Allowed Glycine 0 CA--C 1.526 0.768 0 N-CA-C 110.323 -1.111 . . . . 0.0 110.323 -179.787 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 56.0 m -70.03 79.16 0.49 Allowed 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 169.757 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 21.6 mmtm -55.21 83.63 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.913 1.685 . . . . 0.0 111.393 -178.123 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 75.4 mt -30.29 -58.24 0.19 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 128.155 2.582 . . . . 0.0 113.938 -172.841 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -162.84 162.7 26.58 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 106.506 -1.665 . . . . 0.0 106.506 -175.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -34.33 -42.91 0.15 Allowed 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 128.101 2.56 . . . . 0.0 114.505 -172.63 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.37 -60.91 0.14 Allowed 'General case' 0 C--O 1.226 -0.177 0 C-N-CA 125.874 1.67 . . . . 0.0 113.313 -176.331 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -64.56 -38.09 89.82 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -173.316 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.479 HD12 ' H ' ' A' ' 53' ' ' ILE . 1.2 mp -61.64 -54.97 27.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 N-CA-C 106.159 -1.793 . . . . 0.0 106.159 176.519 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 79.1 t -51.49 -49.62 32.22 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.079 -178.298 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 6.4 mmmm -51.86 -47.61 64.37 Favored 'General case' 0 C--N 1.339 0.111 0 CA-C-N 119.59 1.086 . . . . 0.0 111.753 -176.567 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 32.9 mt -57.33 -35.61 70.1 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 119.283 -0.389 . . . . 0.0 111.543 -178.011 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.28 -62.87 1.55 Allowed 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 176.128 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -40.57 -40.36 1.24 Allowed 'General case' 0 CA--C 1.523 -0.094 0 C-N-CA 127.528 2.331 . . . . 0.0 111.877 -179.351 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -38.52 -47.57 1.3 Allowed 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.811 1.244 . . . . 0.0 112.009 175.715 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -57.6 -51.89 67.65 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 118.124 0.42 . . . . 0.0 110.713 -178.44 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -74.44 -31.38 62.26 Favored 'General case' 0 C--O 1.224 -0.262 0 C-N-CA 123.231 0.613 . . . . 0.0 111.383 -176.215 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.5 ttm180 -63.14 -53.86 46.8 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 173.315 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 -83.17 52.98 2.32 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 123.604 0.762 . . . . 0.0 110.096 -172.652 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 76.6 mttt -58.06 -41.92 84.35 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 108.733 -0.839 . . . . 0.0 108.733 172.803 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -67.5 -5.7 16.3 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.083 1.353 . . . . 0.0 113.163 175.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 66.8 mm-40 70.78 -57.79 0.58 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 126.456 1.902 . . . . 0.0 111.595 -175.17 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -87.2 156.75 19.54 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.572 1.549 . . . . 0.0 110.735 177.607 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 4.2 m -143.93 159.79 16.03 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 127.218 2.207 . . . . 0.0 107.87 174.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -101.04 170.92 7.95 Favored 'General case' 0 N--CA 1.462 0.157 0 C-N-CA 125.086 1.354 . . . . 0.0 110.964 175.812 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 73.9 t80 -35.12 -63.42 0.33 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.685 1.194 . . . . 0.0 112.945 171.859 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 28.9 tp60 -67.03 -29.04 68.74 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 119.633 1.106 . . . . 0.0 111.81 -171.939 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -65.72 -43.23 89.73 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.14 -0.975 . . . . 0.0 109.845 172.671 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -54.43 -49.29 70.33 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.985 -0.447 . . . . 0.0 109.91 170.611 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.8 mm -58.72 -33.53 49.29 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 O-C-N 121.6 -0.688 . . . . 0.0 110.732 175.648 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 32.3 m -70.52 -30.27 66.99 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.07 -1.019 . . . . 0.0 111.04 174.565 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -61.03 -55.45 32.65 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 121.096 -1.003 . . . . 0.0 109.169 170.899 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 44.3 mt -62.36 -40.25 95.8 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.118 0.485 . . . . 0.0 111.535 179.19 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.35 -43.69 96.49 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 110.643 -0.983 . . . . 0.0 110.643 179.617 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.39 -47.8 80.5 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 117.497 0.648 . . . . 0.0 110.444 175.628 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 20.3 tp -48.61 -58.98 3.89 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 121.402 0.62 . . . . 0.0 110.257 172.731 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ALA . . . . . 0.516 ' HB1' HD11 ' B' ' 13' ' ' ILE . . . -49.77 -54.18 20.58 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 124.381 1.073 . . . . 0.0 110.496 179.328 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 46.9 ttm -57.84 -49.78 75.51 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 123.809 0.844 . . . . 0.0 111.091 -178.316 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 67.0 mt -63.35 -49.56 82.37 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 CA-C-O 117.942 -1.028 . . . . 0.0 109.932 -174.13 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.451 0.1 OUTLIER -79.46 -37.66 36.4 Favored 'General case' 0 C--N 1.347 0.488 0 CA-C-N 119.733 1.151 . . . . 0.0 113.837 -178.258 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -80.72 75.12 7.64 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 107.691 -1.225 . . . . 0.0 107.691 171.043 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -47.66 -32.45 5.67 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.627 1.171 . . . . 0.0 112.684 -175.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -40.87 -38.87 1.02 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.673 1.189 . . . . 0.0 113.171 171.654 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 43.7 mt -91.1 12.89 18.47 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.939 1.296 . . . . 0.0 113.828 -173.828 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 19.3 mmtp -65.61 79.39 0.07 Allowed 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 120.14 1.336 . . . . 0.0 113.184 -173.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.16 0 CA-C-O 118.316 -1.269 . . . . 0.0 110.775 174.446 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 28.1 ttt . . . . . 0 N--CA 1.475 0.778 0 CA-C-O 120.494 0.188 . . . . 0.0 110.972 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -69.04 79.97 0.32 Allowed 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.854 0.461 . . . . 0.0 110.101 176.459 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -53.83 159.99 2.38 Favored Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 124.622 1.169 . . . . 0.0 111.248 176.74 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -47.52 -49.62 12.94 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 123.305 2.67 . . . . 0.0 112.806 179.801 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.43 HD23 ' HA ' ' B' ' 5' ' ' LEU . 5.2 mt -58.41 -43.88 88.79 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 119.094 -0.479 . . . . 0.0 111.788 174.873 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -62.86 -42.06 99.61 Favored 'General case' 0 C--O 1.226 -0.143 0 CA-C-N 119.045 0.838 . . . . 0.0 109.489 -177.666 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 12.8 tp60 -61.69 -46.75 88.37 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 122.39 0.276 . . . . 0.0 110.853 175.109 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.28 -46.8 82.09 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.645 0.736 . . . . 0.0 111.275 -177.585 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 74.8 mt -55.74 -50.92 64.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 171.492 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -48.49 -45.89 29.43 Favored Glycine 0 CA--C 1.527 0.787 0 C-N-CA 125.031 1.301 . . . . 0.0 111.468 175.372 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.8 mt -56.27 -57.45 12.18 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 117.613 0.707 . . . . 0.0 110.409 173.284 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -57.12 -43.4 82.32 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 119.371 0.987 . . . . 0.0 112.122 -178.225 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 13' ' ' ILE . . . . . 0.516 HD11 ' HB1' ' A' ' 81' ' ' ALA . 97.2 mt -61.2 -54.08 40.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 123.151 0.58 . . . . 0.0 110.679 175.495 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.99 -51.23 55.16 Favored Glycine 0 CA--C 1.522 0.494 0 N-CA-C 109.666 -1.374 . . . . 0.0 109.666 -177.739 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 8.5 mm -48.04 -54.7 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 C-N-CA 124.279 1.032 . . . . 0.0 110.277 173.03 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -53.29 -62.15 1.84 Allowed 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 121.347 0.594 . . . . 0.0 110.257 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 54.7 t60 -72.63 -12.91 61.24 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 118.971 -0.538 . . . . 0.0 112.393 -170.812 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -54.96 -44.48 74.4 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.423 1.01 . . . . 0.0 108.778 169.093 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -94.15 73.07 3.99 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 104.9 -2.259 . . . . 0.0 104.9 171.122 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 85.1 p -60.58 69.37 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 127.227 2.211 . . . . 0.0 114.376 -167.678 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . 36.4 47.85 1.16 Allowed Glycine 0 CA--C 1.525 0.685 0 C-N-CA 126.981 2.229 . . . . 0.0 113.79 176.074 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 6.7 mtpm? -57.7 -36.11 71.52 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.74 0.816 . . . . 0.0 110.992 -169.725 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -78.92 2.03 21.59 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -178.163 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -171.02 -122.83 0.66 Allowed Glycine 0 C--N 1.339 0.698 0 CA-C-N 120.325 1.42 . . . . 0.0 111.861 177.156 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -79.22 149.85 31.78 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 172.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 10.4 mmpt? -68.11 0.9 3.17 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 -168.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 6.4 p-80 -123.28 23.37 9.11 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.433 1.093 . . . . 0.0 111.58 168.58 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 71.6 p -134.43 145.03 48.5 Favored 'General case' 0 C--O 1.227 -0.089 0 C-N-CA 124.921 1.288 . . . . 0.0 108.246 175.643 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -156.57 163.03 39.84 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-N 119.323 0.965 . . . . 0.0 110.69 -178.092 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 29.9 t -120.99 -168.65 1.7 Allowed 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.635 0.731 . . . . 0.0 110.944 -176.197 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 10.3 pttm -46.99 -50.98 18.22 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 126.893 2.077 . . . . 0.0 113.131 -171.128 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -55.48 -52.13 64.66 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 120.762 0.315 . . . . 0.0 110.294 -179.132 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -67.04 -35.66 80.37 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 118.436 -0.792 . . . . 0.0 111.8 -179.456 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 30.0 mt -64.03 -52.3 60.14 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 119.966 1.257 . . . . 0.0 111.149 175.145 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 90.4 mttt -56.38 -43.83 79.6 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 122.707 0.403 . . . . 0.0 110.044 177.317 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 65.7 tt0 -54.09 -66.45 0.39 Allowed 'General case' 0 C--O 1.223 -0.334 0 CA-C-O 118.895 -0.574 . . . . 0.0 109.523 171.448 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 3.8 mt -37.54 -60.09 0.72 Allowed 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 125.364 1.465 . . . . 0.0 111.565 179.53 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 14.3 tt -62.55 -45.2 99.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.265 -176.094 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 -57.34 -52.96 63.22 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 121.343 -0.848 . . . . 0.0 111.731 177.648 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 11.4 mmpt? -66.76 -49.29 66.4 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.059 0.544 . . . . 0.0 110.497 -174.562 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 70.1 mm-40 -98.06 -16.65 19.51 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 115.06 1.504 . . . . 0.0 115.06 -166.77 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 13.5 mt -118.36 79.78 1.43 Allowed 'General case' 0 CA--C 1.523 -0.088 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 171.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 65.7 p -79.13 51.22 1.14 Allowed 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.374 1.07 . . . . 0.0 109.445 -178.385 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 27.7 mt -87.88 70.86 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 -179.154 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -54.29 -50.65 55.35 Favored Glycine 0 CA--C 1.527 0.785 0 N-CA-C 109.631 -1.387 . . . . 0.0 109.631 175.022 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 7.1 m -71.24 72.21 0.63 Allowed 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.738 0.815 . . . . 0.0 109.299 169.469 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 25.9 mmtp -48.2 93.74 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.993 1.717 . . . . 0.0 111.011 -177.777 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 97.5 mt -44.99 -52.82 8.42 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 125.479 1.512 . . . . 0.0 113.167 -169.749 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -161.9 161.86 28.98 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 106.288 -1.745 . . . . 0.0 106.288 -174.589 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -35.67 -42.08 0.23 Allowed 'General case' 0 C--O 1.225 -0.222 0 C-N-CA 128.008 2.523 . . . . 0.0 114.364 -172.032 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.64 -56.25 0.16 Allowed 'General case' 0 CA--C 1.527 0.092 0 C-N-CA 126.118 1.767 . . . . 0.0 114.455 -177.587 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -67.45 -39.54 85.37 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 120.912 0.387 . . . . 0.0 111.148 -174.436 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 53' ' ' ILE . . . . . 0.56 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.5 mp -61.68 -51.4 73.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 176.807 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 76.9 t -57.34 -42.4 80.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 C-N-CA 123.938 0.895 . . . . 0.0 110.475 -179.417 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.76 -55.21 37.79 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 119.433 1.015 . . . . 0.0 110.443 173.089 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 49.0 mt -53.35 -37.96 62.84 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 122.489 0.316 . . . . 0.0 111.544 -179.55 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.72 -65.56 0.81 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.236 0.471 . . . . 0.0 109.961 175.721 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -40.32 -39.88 1.05 Allowed 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 127.489 2.316 . . . . 0.0 111.991 -177.95 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -37.04 -51.34 0.94 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.172 1.389 . . . . 0.0 111.816 172.923 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -58.75 -35.64 73.05 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 121.43 -0.794 . . . . 0.0 112.232 -176.591 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -80.75 -49.57 10.98 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 123.141 0.577 . . . . 0.0 109.629 179.385 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 14.8 ttm180 -50.89 -46.72 60.64 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.617 0.767 . . . . 0.0 110.164 178.901 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -83.29 20.51 1.29 Allowed 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 123.257 0.623 . . . . 0.0 112.37 -179.104 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -57.86 -41.06 81.64 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 108.004 -1.109 . . . . 0.0 108.004 167.406 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -82.07 14.6 2.74 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.263 1.025 . . . . 0.0 111.81 173.774 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 41.1 mm-40 56.33 -95.04 0.05 OUTLIER 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.874 1.67 . . . . 0.0 112.427 -178.377 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 50.0 mm-40 -75.25 108.85 8.29 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 124.355 1.062 . . . . 0.0 112.469 -168.215 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 32.7 m -87.13 148.52 4.56 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 N-CA-C 107.483 -1.302 . . . . 0.0 107.483 167.308 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 15.5 p-10 -91.18 -176.68 4.66 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 123.94 0.896 . . . . 0.0 111.403 177.341 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -49.84 -62.09 1.76 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.853 0.861 . . . . 0.0 112.293 177.256 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 41.1 tp60 -60.4 -37.25 80.23 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 119.299 0.954 . . . . 0.0 111.17 -174.064 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -62.66 -46.07 89.9 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.711 -0.618 . . . . 0.0 110.705 175.753 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -55.15 -49.81 70.89 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.846 -0.534 . . . . 0.0 110.148 171.59 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 26.8 mm -56.98 -28.48 28.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 O-C-N 121.799 -0.563 . . . . 0.0 110.464 175.425 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 27.8 m -80.96 -24.48 38.07 Favored 'General case' 0 CA--C 1.529 0.171 0 O-C-N 121.301 -0.874 . . . . 0.0 112.986 173.459 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -62.9 -52.74 61.9 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 107.117 -1.438 . . . . 0.0 107.117 167.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 48.9 mt -62.22 -40.9 97.65 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 120.888 0.375 . . . . 0.0 111.726 175.295 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -60.82 -49.53 77.58 Favored Glycine 0 CA--C 1.521 0.428 0 N-CA-C 110.53 -1.028 . . . . 0.0 110.53 -179.128 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.49 -47.44 85.66 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.155 0.582 . . . . 0.0 110.026 175.801 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 19.5 tp -49.59 -57.22 7.54 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.455 0.645 . . . . 0.0 109.853 175.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 81' ' ' ALA . . . . . 0.415 ' HB1' HD11 ' A' ' 13' ' ' ILE . . . -51.64 -56.47 13.41 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 124.71 1.204 . . . . 0.0 110.55 178.724 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 55.5 ttm -54.56 -46.97 73.75 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.172 0.989 . . . . 0.0 111.177 -178.86 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.1 mt -66.52 -52.86 41.57 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.301 0 CA-C-O 117.922 -1.037 . . . . 0.0 110.399 -175.145 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.436 0.0 OUTLIER -80.46 -33.59 36.59 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 120.027 1.285 . . . . 0.0 114.141 -176.611 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 22.6 m-80 -81.33 70.03 8.09 Favored 'General case' 0 CA--C 1.523 -0.088 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 170.166 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -42.82 -38.25 2.08 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 126.024 1.73 . . . . 0.0 111.699 -176.134 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -34.02 -47.68 0.28 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 126.551 1.94 . . . . 0.0 113.343 170.62 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 64.5 mt -61.64 -28.4 69.35 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.126 0.571 . . . . 0.0 112.443 -177.382 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -85.89 -49.17 8.08 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 118.336 0.516 . . . . 0.0 109.623 171.311 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.12 0 CA-C-O 117.601 -1.666 . . . . 0.0 110.031 -176.887 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.1 tpt . . . . . 0 N--CA 1.473 0.693 0 N-CA-C 110.434 -0.21 . . . . 0.0 110.434 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -73.24 77.15 1.31 Allowed 'General case' 0 CA--C 1.531 0.223 0 O-C-N 122.047 -0.408 . . . . 0.0 109.916 175.593 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.1 m -51.84 158.19 1.75 Allowed Pre-proline 0 CA--C 1.54 0.558 0 C-N-CA 124.149 0.98 . . . . 0.0 110.802 171.688 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -48.47 -48.9 15.81 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 122.944 2.429 . . . . 0.0 112.752 -179.196 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.9 mt -59.95 -44.91 94.11 Favored 'General case' 0 C--O 1.224 -0.251 0 CA-C-O 119.299 -0.381 . . . . 0.0 111.328 175.522 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -58.89 -46.82 86.94 Favored 'General case' 0 CA--C 1.528 0.12 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 -178.143 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -57.68 -52.4 65.58 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.383 0.673 . . . . 0.0 110.743 175.76 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.95 -46.2 88.88 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.407 0.622 . . . . 0.0 111.783 -175.669 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 71.2 mt -54.65 -51.88 46.69 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 171.282 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.55 -48.31 17.06 Favored Glycine 0 CA--C 1.527 0.814 0 C-N-CA 124.725 1.155 . . . . 0.0 111.804 174.804 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 mt -55.74 -56.42 20.65 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 117.613 0.706 . . . . 0.0 111.078 174.365 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 mp -58.3 -44.15 88.43 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 118.979 0.809 . . . . 0.0 111.696 -178.362 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 83.3 mt -55.81 -55.14 19.43 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.185 0 C-N-CA 123.316 0.646 . . . . 0.0 109.975 173.283 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.06 -50.03 56.89 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 110.541 -1.024 . . . . 0.0 110.541 -177.563 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 11.7 mm -53.03 -49.2 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 C-N-CA 123.371 0.668 . . . . 0.0 110.271 175.776 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -56.4 -62.96 1.36 Allowed 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 121.293 0.568 . . . . 0.0 109.622 177.05 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -51.82 -39.68 59.19 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.8 1.24 . . . . 0.0 111.689 -174.049 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.5 tttp -48.97 -39.42 26.49 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.079 0.951 . . . . 0.0 111.441 178.01 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -100.01 -59.85 1.64 Allowed 'General case' 0 C--O 1.234 0.261 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.6 m -51.11 -45.8 61.66 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.049 0.94 . . . . 0.0 111.117 -175.662 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -80.3 23.41 4.0 Favored Glycine 0 C--N 1.336 0.529 0 CA-C-O 118.624 -1.098 . . . . 0.0 113.389 -175.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -148.55 -51.58 0.17 Allowed 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 118.73 1.265 . . . . 0.0 111.31 168.079 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -101.7 46.58 0.93 Allowed 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.648 0.779 . . . . 0.0 109.763 -175.646 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 166.13 -151.86 20.57 Favored Glycine 0 CA--C 1.523 0.556 0 N-CA-C 105.649 -2.981 . . . . 0.0 105.649 -172.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -114.1 145.74 41.21 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 107.297 -1.372 . . . . 0.0 107.297 168.499 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.59 -20.21 4.85 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 -177.781 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 1.8 m170 -92.92 -29.9 15.66 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.212 1.005 . . . . 0.0 113.256 176.358 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 60.3 p -144.73 141.39 29.22 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.712 1.205 . . . . 0.0 112.721 -167.613 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -145.64 168.84 19.69 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 123.236 0.614 . . . . 0.0 110.531 176.017 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 72.8 m -111.1 177.05 4.78 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.187 1.395 . . . . 0.0 113.73 -174.148 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.5 ptpt -41.92 -53.7 3.72 Favored 'General case' 0 C--N 1.339 0.146 0 C-N-CA 126.602 1.961 . . . . 0.0 114.594 -176.46 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 23.5 ttmm -54.75 -50.09 69.26 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 -177.629 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -58.56 -44.14 89.61 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-O 118.693 -0.67 . . . . 0.0 111.098 177.515 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 90.0 mt -59.02 -51.2 71.09 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 119.17 0.896 . . . . 0.0 111.52 176.747 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 54.5 mtmt -59.01 -47.66 84.39 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 -179.022 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.3 -54.15 48.84 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-O 119.28 -0.39 . . . . 0.0 110.836 174.105 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.6 mt -44.77 -64.4 0.71 Allowed 'General case' 0 CA--C 1.522 -0.109 0 C-N-CA 124.25 1.02 . . . . 0.0 110.425 177.771 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 18.3 tt -60.24 -49.62 83.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 120.174 -0.61 . . . . 0.0 109.989 -175.28 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -55.93 -49.2 74.16 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.579 0.752 . . . . 0.0 112.332 -176.884 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.46 -54.4 7.09 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 -176.946 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -73.8 -29.98 62.47 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 118.302 -0.856 . . . . 0.0 112.72 -168.322 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 59.7 mt -94.4 95.71 9.04 Favored 'General case' 0 C--N 1.339 0.126 0 N-CA-C 107.221 -1.399 . . . . 0.0 107.221 167.847 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 71.0 p -75.87 60.16 1.32 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.467 1.107 . . . . 0.0 109.251 178.839 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 28.6 mt -86.91 -58.36 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 C-N-CA 124.501 1.12 . . . . 0.0 109.13 -173.094 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.54 -67.69 0.75 Allowed Glycine 0 CA--C 1.531 1.093 0 N-CA-C 110.326 -1.109 . . . . 0.0 110.326 -171.45 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 14.1 m -69.29 73.51 0.33 Allowed 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.483 1.513 . . . . 0.0 110.977 175.371 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.431 ' HB3' HD11 ' A' ' 53' ' ' ILE . 50.2 mmtm -28.72 88.89 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 128.668 2.787 . . . . 0.0 113.31 178.44 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.9 mt -60.32 118.93 7.02 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.04 0.936 . . . . 0.0 113.273 -169.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 23.9 tt0 65.41 -71.46 0.08 Allowed 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 127.125 2.17 . . . . 0.0 114.098 168.047 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -179.9 -42.94 0.01 OUTLIER 'General case' 0 C--O 1.227 -0.128 0 C-N-CA 125.145 1.378 . . . . 0.0 109.339 -168.174 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -38.54 -61.47 0.7 Allowed 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 125.035 1.334 . . . . 0.0 112.938 -176.692 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 58.6 tt0 -61.22 -37.82 84.39 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.047 0.539 . . . . 0.0 110.89 -175.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.501 ' H ' ' CD1' ' A' ' 53' ' ' ILE . 0.9 OUTLIER -62.55 -54.18 37.33 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 N-CA-C 105.974 -1.862 . . . . 0.0 105.974 -178.926 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 59.9 t -54.94 -39.76 50.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 CA-C-O 118.118 -0.944 . . . . 0.0 110.702 176.844 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 12.6 mmmt -59.96 -51.53 69.27 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 120.226 1.376 . . . . 0.0 110.414 176.292 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 85.1 mt -57.34 -37.6 72.8 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 119.322 -0.371 . . . . 0.0 110.828 -179.474 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 24.0 mmt -70.34 -62.85 1.23 Allowed 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 118.59 0.632 . . . . 0.0 109.992 175.503 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -44.29 -42.47 6.71 Favored 'General case' 0 CA--C 1.52 -0.19 0 C-N-CA 127.472 2.309 . . . . 0.0 111.425 -176.823 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -38.0 -50.87 1.36 Allowed 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.087 1.355 . . . . 0.0 111.391 174.178 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 71.1 mt -60.54 -35.78 76.85 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 121.924 -0.485 . . . . 0.0 111.667 -175.514 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -80.81 -54.76 5.32 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.437 0.695 . . . . 0.0 109.824 179.716 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 14.7 ttm180 -45.45 -49.8 13.13 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 124.473 1.109 . . . . 0.0 110.044 177.741 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -87.26 26.84 1.14 Allowed 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -174.058 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 28.5 mtmm -57.19 -36.54 70.95 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 120.016 1.28 . . . . 0.0 109.101 167.351 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -73.29 6.87 2.56 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.129 0.972 . . . . 0.0 112.652 173.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 66.14 -74.97 0.06 Allowed 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 126.378 1.871 . . . . 0.0 110.408 -174.2 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -82.05 150.5 27.53 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.766 1.226 . . . . 0.0 111.587 -173.463 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 23.4 m -130.86 147.2 33.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 N-CA-C 105.65 -1.981 . . . . 0.0 105.65 166.641 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -88.53 168.29 12.71 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 122.719 0.408 . . . . 0.0 111.194 175.832 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -33.45 -61.55 0.31 Allowed 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.722 1.209 . . . . 0.0 112.854 171.818 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 38.6 tp60 -61.92 -33.27 73.94 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 119.794 1.179 . . . . 0.0 112.042 -174.673 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -70.18 -40.01 74.92 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.249 -0.907 . . . . 0.0 110.095 177.076 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -56.92 -48.5 78.11 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 169.967 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ILE . . . . . 0.403 ' CG2' ' CG2' ' B' ' 74' ' ' ILE . 27.3 mm -58.23 -36.64 58.62 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.255 0 O-C-N 121.535 -0.728 . . . . 0.0 110.006 175.701 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 42.5 m -64.35 -38.54 91.4 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.931 0.787 . . . . 0.0 110.489 174.645 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -55.88 -55.41 32.89 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 172.677 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 36.3 mt -59.37 -41.98 90.58 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.987 -0.445 . . . . 0.0 112.133 178.262 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.38 -39.96 87.21 Favored Glycine 0 CA--C 1.523 0.593 0 N-CA-C 110.638 -0.985 . . . . 0.0 110.638 -175.583 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.01 -50.03 67.87 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 117.597 0.699 . . . . 0.0 109.938 173.758 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -47.92 -56.84 6.64 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 123.988 0.915 . . . . 0.0 110.05 175.256 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.86 -62.5 1.57 Allowed 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 124.677 1.191 . . . . 0.0 110.327 175.081 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 6.5 ttp -54.92 -37.94 67.02 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.121 0.569 . . . . 0.0 112.039 -173.857 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 73.6 mt -69.82 -57.84 7.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 CA-C-O 117.975 -1.012 . . . . 0.0 110.877 178.083 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.438 0.2 OUTLIER -77.76 -35.14 52.05 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 120.313 1.415 . . . . 0.0 113.814 -174.208 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.3 m120 -80.55 58.79 3.32 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 106.425 -1.694 . . . . 0.0 106.425 168.535 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -47.09 -35.22 6.74 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 126.769 2.028 . . . . 0.0 113.505 -167.872 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -43.12 -36.95 1.85 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.706 1.203 . . . . 0.0 112.953 175.043 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 34.0 mt -55.02 -34.83 63.8 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 178.011 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -78.34 56.51 1.74 Allowed 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 119.185 0.902 . . . . 0.0 111.042 -178.172 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.338 0 CA-C-O 117.423 -1.765 . . . . 0.0 111.109 174.572 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 21.7 ptm . . . . . 0 N--CA 1.479 0.993 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -73.3 75.36 1.34 Allowed 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.111 0.564 . . . . 0.0 110.189 179.247 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.09 165.55 1.39 Allowed Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 125.53 1.532 . . . . 0.0 111.756 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo -46.14 -50.77 9.5 Favored 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 123.528 2.819 . . . . 0.0 113.052 177.908 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 5' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' B' ' 5' ' ' LEU . 6.0 mt -55.9 -52.51 63.85 Favored 'General case' 0 C--N 1.34 0.175 0 O-C-N 122.328 -0.233 . . . . 0.0 111.115 175.109 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -58.78 -43.59 90.49 Favored 'General case' 0 C--O 1.225 -0.201 0 N-CA-C 110.118 -0.326 . . . . 0.0 110.118 -175.217 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 tp-100 -61.94 -49.72 75.0 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.147 0.979 . . . . 0.0 110.441 177.534 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.87 -44.2 96.74 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.039 0.536 . . . . 0.0 111.222 -178.192 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 71.3 mt -54.4 -53.31 31.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 169.917 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -44.97 -48.25 9.45 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 124.947 1.261 . . . . 0.0 111.923 174.436 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 mt -56.61 -57.93 10.24 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 117.679 0.739 . . . . 0.0 110.895 174.199 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.0 mp -56.41 -42.77 78.54 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 119.483 1.038 . . . . 0.0 111.75 -178.35 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 71.6 mt -59.3 -55.25 24.87 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 C-N-CA 123.508 0.723 . . . . 0.0 110.779 174.697 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.91 -48.99 69.12 Favored Glycine 0 CA--C 1.523 0.549 0 N-CA-C 110.198 -1.161 . . . . 0.0 110.198 -177.854 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 9.5 mm -51.25 -49.81 28.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 C-N-CA 124.34 1.056 . . . . 0.0 110.103 173.687 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -56.18 -61.64 2.26 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.082 0.468 . . . . 0.0 109.772 177.509 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 13.5 m-70 -53.0 -37.09 61.16 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.936 0.894 . . . . 0.0 112.812 -176.679 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 62.3 tttm -47.12 -35.67 7.45 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.904 0.881 . . . . 0.0 111.368 175.862 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -102.95 -66.99 0.9 Allowed 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 173.804 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -52.99 -41.08 64.27 Favored 'General case' 0 C--O 1.227 -0.111 0 C-N-CA 123.899 0.88 . . . . 0.0 112.152 -170.726 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -54.7 -15.09 5.8 Favored Glycine 0 CA--C 1.527 0.793 0 CA-C-O 118.486 -1.175 . . . . 0.0 113.949 -179.009 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.61 -50.36 0.61 Allowed 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 118.978 1.389 . . . . 0.0 111.779 170.631 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -77.66 70.31 4.02 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.282 -0.886 . . . . 0.0 109.6 177.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 134.68 -121.77 2.73 Favored Glycine 0 CA--C 1.521 0.411 0 N-CA-C 107.358 -2.297 . . . . 0.0 107.358 -179.368 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -140.3 153.87 46.61 Favored 'General case' 0 N--CA 1.452 -0.325 0 N-CA-C 106.331 -1.729 . . . . 0.0 106.331 168.78 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -50.17 -21.29 1.26 Allowed 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 113.812 1.041 . . . . 0.0 113.812 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 13.9 t-160 -91.17 -28.79 17.63 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 126.045 1.738 . . . . 0.0 114.308 176.421 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 45.4 p -140.07 148.75 42.22 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.329 1.052 . . . . 0.0 113.804 -168.1 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -151.61 173.44 14.65 Favored 'General case' 0 CA--C 1.527 0.067 0 C-N-CA 123.263 0.625 . . . . 0.0 110.03 171.471 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 22.2 p -117.67 174.24 6.28 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 124.495 1.118 . . . . 0.0 113.318 -169.539 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 6.6 pttp -34.79 -59.77 0.47 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 126.867 2.067 . . . . 0.0 112.986 175.723 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 35.3 tptt -44.87 -49.51 10.87 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 124.558 1.143 . . . . 0.0 111.797 176.597 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -70.34 -36.0 73.94 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 122.902 0.481 . . . . 0.0 110.632 -176.329 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 34.6 mt -64.33 -46.66 82.54 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.647 0.658 . . . . 0.0 110.789 174.673 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -55.6 -51.87 65.7 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 174.869 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 68.3 mt-10 -56.51 -47.43 79.36 Favored 'General case' 0 C--O 1.218 -0.56 0 CA-C-O 118.969 -0.539 . . . . 0.0 110.856 176.073 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 8.5 mt -51.0 -53.22 35.23 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 119.574 1.079 . . . . 0.0 110.464 179.339 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 1.4 mp -56.09 -58.61 4.51 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 174.597 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -55.23 -43.93 75.01 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -172.254 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 6.9 mmpt? -83.11 -54.59 4.93 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 125.667 1.587 . . . . 0.0 109.916 -172.662 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 44.7 mm-40 -94.42 -17.26 22.68 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 -167.798 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 67.4 mt -118.54 69.82 0.8 Allowed 'General case' 0 N--CA 1.457 -0.082 0 C-N-CA 123.907 0.883 . . . . 0.0 108.997 170.793 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 14.3 p -57.6 -38.18 74.49 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 168.272 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . 0.289 4.4 tt 60.03 -50.72 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 130.182 3.393 . . . . 0.0 116.874 167.55 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 134.19 -152.15 20.5 Favored Glycine 0 CA--C 1.523 0.552 0 N-CA-C 106.142 -2.783 . . . . 0.0 106.142 -169.535 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 3.9 m -75.04 58.56 0.88 Allowed 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 117.806 0.803 . . . . 0.0 112.521 -177.117 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 22.3 mmtm 43.53 70.26 0.33 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.66 1.584 . . . . 0.0 110.581 178.257 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 16.7 mt -58.33 83.16 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.258 1.423 . . . . 0.0 113.352 -169.246 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 82.37 153.93 0.11 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 127.137 2.175 . . . . 0.0 111.225 173.44 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -42.24 -38.34 1.74 Allowed 'General case' 0 C--O 1.226 -0.142 0 C-N-CA 127.236 2.214 . . . . 0.0 113.523 -170.307 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.49 -60.31 0.15 Allowed 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 126.076 1.75 . . . . 0.0 113.344 -179.195 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -69.75 -36.84 76.15 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 122.248 0.219 . . . . 0.0 111.194 -172.929 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 53' ' ' ILE . . . . . 0.517 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.3 mp -62.86 -55.3 24.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 178.455 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 78.3 t -55.84 -46.01 79.9 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 C-N-CA 124.709 1.204 . . . . 0.0 110.015 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -53.6 -53.47 51.28 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 118.216 0.462 . . . . 0.0 110.791 173.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 68.7 mt -56.53 -43.86 80.26 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 119.116 -0.468 . . . . 0.0 111.452 178.81 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 25.7 mmt -62.42 -59.27 5.22 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 118.816 0.734 . . . . 0.0 109.393 178.765 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -54.22 -40.76 67.97 Favored 'General case' 0 N--CA 1.457 -0.112 0 C-N-CA 125.303 1.441 . . . . 0.0 111.007 -175.397 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -38.93 -50.97 1.78 Allowed 'General case' 0 C--O 1.232 0.158 0 C-N-CA 125.747 1.619 . . . . 0.0 112.555 -173.794 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 3.0 pp -58.86 -39.26 80.81 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 -176.127 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -77.0 -45.7 26.42 Favored 'General case' 0 N--CA 1.456 -0.157 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 177.51 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 23.4 ttm-85 -48.93 -44.53 40.55 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.532 0.733 . . . . 0.0 109.979 179.086 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 -86.31 34.89 0.64 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.1 0.56 . . . . 0.0 111.86 179.561 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -55.2 -32.57 62.33 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 121.11 -0.994 . . . . 0.0 110.416 168.748 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -79.72 13.08 2.25 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.371 1.068 . . . . 0.0 112.566 174.409 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 68.75 -61.61 0.41 Allowed 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 127.348 2.259 . . . . 0.0 112.386 -177.187 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -110.99 158.34 18.89 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.326 1.051 . . . . 0.0 111.818 -177.468 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 36.0 m -124.9 152.39 31.19 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 C-N-CA 126.607 1.963 . . . . 0.0 106.081 167.743 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 10.6 p30 -91.5 169.23 10.94 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 123.156 0.582 . . . . 0.0 110.54 175.389 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -35.58 -60.67 0.5 Allowed 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 125.125 1.37 . . . . 0.0 113.243 177.019 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 37.9 tp60 -63.88 -31.46 72.65 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 119.752 1.16 . . . . 0.0 111.294 -173.012 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.67 -36.39 62.8 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 121.56 -0.712 . . . . 0.0 110.186 177.848 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -56.86 -49.59 75.04 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 168.363 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 74' ' ' ILE . . . . . 0.403 ' CG2' ' CG2' ' A' ' 74' ' ' ILE . 24.2 mm -57.38 -39.1 66.24 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 O-C-N 121.963 -0.461 . . . . 0.0 110.012 175.821 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 55.3 m -62.45 -40.82 97.85 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 118.946 0.793 . . . . 0.0 110.608 175.769 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -53.37 -55.98 20.53 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 173.492 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 51.0 mt -61.16 -40.86 95.45 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 179.865 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -70.26 -43.87 61.7 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 110.788 -0.925 . . . . 0.0 110.788 -174.931 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.5 -46.89 81.01 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 117.705 0.752 . . . . 0.0 109.894 174.466 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 12.2 tp -49.7 -56.05 11.58 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.419 0.628 . . . . 0.0 109.559 174.274 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.08 -53.63 40.01 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.882 1.273 . . . . 0.0 110.802 177.481 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 52.9 ttm -54.11 -49.58 68.8 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 124.31 1.044 . . . . 0.0 110.552 -179.65 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 76.4 mt -62.54 -59.19 4.75 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.33 0 CA-C-O 118.701 -0.666 . . . . 0.0 109.586 -176.475 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.388 0.1 OUTLIER -71.25 -35.11 71.3 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 118.467 -1.293 . . . . 0.0 112.938 -174.365 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 37.3 m-80 -81.07 72.08 8.08 Favored 'General case' 0 N--CA 1.462 0.16 0 O-C-N 120.793 -1.192 . . . . 0.0 108.157 170.507 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -43.81 -34.45 1.58 Allowed 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 124.918 1.287 . . . . 0.0 112.725 -179.062 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -41.1 -42.82 2.08 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.876 1.27 . . . . 0.0 113.189 173.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 96.1 mt -72.37 -18.06 61.77 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.409 0.684 . . . . 0.0 112.718 -177.432 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -92.36 -43.76 9.07 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.714 0.806 . . . . 0.0 109.933 173.036 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.177 0 CA-C-O 116.583 -2.232 . . . . 0.0 110.093 -179.145 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.474 0.736 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -78.63 73.79 5.18 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 121.192 0.52 . . . . 0.0 111.085 -174.586 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.34 167.79 3.7 Favored Pre-proline 0 CA--C 1.534 0.347 0 C-N-CA 124.795 1.238 . . . . 0.0 111.339 172.878 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_endo -49.63 -45.05 33.08 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 122.926 2.417 . . . . 0.0 111.428 171.28 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.415 HD23 ' HA ' ' A' ' 5' ' ' LEU . 4.1 mt -53.74 -57.35 11.15 Favored 'General case' 0 C--O 1.224 -0.283 0 CA-C-N 118.02 0.373 . . . . 0.0 111.317 171.606 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -56.84 -42.23 79.29 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.176 0.444 . . . . 0.0 110.831 -174.999 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 -59.74 -50.71 72.76 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.54 0.736 . . . . 0.0 110.842 175.509 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.01 -45.96 83.37 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.577 0.751 . . . . 0.0 111.632 -176.462 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 87.1 mt -53.48 -51.02 45.67 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 169.887 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.04 -49.03 18.91 Favored Glycine 0 CA--C 1.528 0.88 0 C-N-CA 124.923 1.249 . . . . 0.0 112.005 173.55 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 mt -56.82 -55.16 37.89 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 117.947 0.873 . . . . 0.0 110.864 174.893 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.0 mp -57.49 -43.6 84.27 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 119.136 0.88 . . . . 0.0 111.38 -179.024 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 95.4 mt -58.32 -53.11 50.65 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.193 0 C-N-CA 123.497 0.719 . . . . 0.0 110.362 174.207 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.42 -49.66 67.53 Favored Glycine 0 CA--C 1.524 0.596 0 N-CA-C 110.322 -1.111 . . . . 0.0 110.322 -177.953 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 9.6 mm -53.32 -48.52 55.91 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 C-N-CA 123.572 0.749 . . . . 0.0 109.885 174.91 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 53.1 t80 -56.09 -61.13 2.59 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.258 0.481 . . . . 0.0 110.056 176.921 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -51.06 -39.69 56.56 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 125.74 1.616 . . . . 0.0 111.503 -176.27 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -50.93 -36.17 37.18 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.715 0.806 . . . . 0.0 111.506 178.913 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -107.05 -38.21 6.09 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.078 0.551 . . . . 0.0 111.654 -177.929 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 59.6 p -73.88 -37.38 64.74 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 118.801 0.728 . . . . 0.0 111.772 -178.749 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -72.35 64.63 1.35 Allowed Glycine 0 C--N 1.34 0.753 0 C-N-CA 125.326 1.441 . . . . 0.0 111.788 -171.078 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.1 ptpp? 178.39 -33.37 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 127.51 2.324 . . . . 0.0 110.241 -174.739 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -77.04 47.16 0.52 Allowed 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 119.002 0.819 . . . . 0.0 112.041 -177.867 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 61.64 -81.12 0.02 OUTLIER Glycine 0 CA--C 1.528 0.888 0 C-N-CA 124.688 1.137 . . . . 0.0 111.753 -179.118 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 48.6 t0 -80.03 95.08 6.06 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 176.493 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 51.0 mttp -67.65 -10.1 49.19 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.159 0.984 . . . . 0.0 112.818 -172.217 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 20.6 t-160 -77.87 -11.16 59.87 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.262 1.425 . . . . 0.0 111.066 172.077 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.3 p -123.13 156.57 34.75 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 124.116 0.966 . . . . 0.0 111.841 179.605 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -150.21 161.58 42.14 Favored 'General case' 0 CA--C 1.528 0.109 0 C-N-CA 123.034 0.534 . . . . 0.0 111.177 168.649 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 83.7 p -87.07 164.74 16.27 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 115.638 1.718 . . . . 0.0 115.638 -168.063 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 20.7 ttmm -42.6 -54.17 4.09 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 126.878 2.071 . . . . 0.0 109.442 166.685 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -58.01 -54.27 48.79 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.075 0.95 . . . . 0.0 109.782 179.247 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.12 -34.19 73.17 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 118.91 -0.567 . . . . 0.0 111.746 -177.49 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 44.0 mt -65.61 -52.71 49.95 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 119.276 0.943 . . . . 0.0 111.345 173.999 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -60.45 -35.96 77.08 Favored 'General case' 0 CA--C 1.532 0.261 0 O-C-N 122.3 -0.25 . . . . 0.0 110.439 -179.43 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 88.4 mt-10 -60.13 -68.71 0.27 Allowed 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 168.383 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.5 mt -32.57 -61.65 0.26 Allowed 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 125.94 1.696 . . . . 0.0 112.388 -177.965 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.3 tt -57.14 -52.19 59.41 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 110.337 -0.246 . . . . 0.0 110.337 -174.844 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.0 tt0 -64.33 -44.99 89.81 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 121.905 -0.497 . . . . 0.0 111.643 -177.874 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.0 mmpt? -64.6 -51.35 63.16 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 124.894 1.278 . . . . 0.0 110.219 -175.619 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 65.1 mm-40 -90.24 -47.52 7.73 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 123.483 0.713 . . . . 0.0 111.582 -168.911 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 18.1 mt -83.17 63.41 7.16 Favored 'General case' 0 C--N 1.339 0.122 0 CA-C-N 118.976 0.807 . . . . 0.0 110.386 -177.828 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 53.2 p -74.83 69.06 1.81 Allowed 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 105.163 -2.162 . . . . 0.0 105.163 167.412 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.496 HG23 ' O ' ' A' ' 46' ' ' SER . 10.5 tt -81.81 49.44 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 124.21 1.004 . . . . 0.0 111.43 -166.982 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.65 -64.0 1.48 Allowed Glycine 0 CA--C 1.53 1.019 0 N-CA-C 110.134 -1.186 . . . . 0.0 110.134 -170.858 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.496 ' O ' HG23 ' A' ' 44' ' ' ILE . 36.4 t -158.9 -172.35 3.77 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 106.394 -1.706 . . . . 0.0 106.394 169.736 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 39.1 mmtm -72.31 74.57 1.0 Allowed 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.291 0.636 . . . . 0.0 109.718 179.276 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 36.0 mt -52.28 -46.85 66.04 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.697 0.799 . . . . 0.0 112.962 -170.372 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 tm0? -156.26 149.93 24.86 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 -172.2 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -20.74 -48.42 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 130.723 3.609 . . . . 0.0 116.066 179.108 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -33.03 -59.06 0.36 Allowed 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.591 1.556 . . . . 0.0 113.396 -179.454 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -64.94 -36.88 85.8 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 121.255 0.55 . . . . 0.0 110.775 -173.815 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.499 ' H ' ' CD1' ' A' ' 53' ' ' ILE . 0.8 OUTLIER -65.56 -53.94 33.67 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.572 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 -178.068 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 75.4 t -57.91 -43.82 85.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 CA-C-O 118.633 -0.698 . . . . 0.0 110.451 178.86 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.72 -53.7 51.54 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 119.385 0.993 . . . . 0.0 110.459 174.301 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.6 mt -52.83 -44.26 66.58 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 119.104 -0.474 . . . . 0.0 111.404 178.651 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 25.9 mmt -66.84 -66.15 0.59 Allowed 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.529 0.604 . . . . 0.0 109.456 177.632 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -40.46 -42.68 1.67 Allowed 'General case' 0 CA--C 1.519 -0.243 0 C-N-CA 127.803 2.441 . . . . 0.0 111.648 -176.738 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -39.22 -47.7 1.68 Allowed 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 123.862 0.865 . . . . 0.0 112.72 178.042 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -64.35 -37.22 86.75 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.044 0.384 . . . . 0.0 111.385 -176.162 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -78.87 -36.88 41.52 Favored 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 123.841 0.856 . . . . 0.0 110.104 -178.284 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.2 ttm180 -60.8 -52.33 65.52 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 174.448 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 9.3 m-80 -81.44 47.23 1.02 Allowed 'General case' 0 CA--C 1.531 0.215 0 O-C-N 121.876 -0.515 . . . . 0.0 111.564 -174.346 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 36.4 mttp -59.23 -42.52 91.23 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 167.832 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -76.08 12.07 1.27 Allowed 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.227 1.011 . . . . 0.0 112.534 173.727 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 78.1 mm-40 70.62 -35.58 0.33 Allowed 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.183 1.793 . . . . 0.0 114.781 175.292 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -124.43 165.43 17.76 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 124.761 1.225 . . . . 0.0 111.803 176.483 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 16.3 m -128.04 157.17 40.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.279 0 C-N-CA 125.325 1.45 . . . . 0.0 107.787 168.62 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -87.18 171.28 10.79 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.048 0.939 . . . . 0.0 111.495 173.522 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 68.8 t80 -44.45 -62.43 1.18 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.945 0.898 . . . . 0.0 113.141 176.172 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 37.0 tp60 -61.61 -34.48 75.73 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 119.722 1.146 . . . . 0.0 110.89 -174.795 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 83.5 mt-10 -64.45 -41.06 96.76 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.445 -0.784 . . . . 0.0 110.925 175.029 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -57.47 -47.97 80.44 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 121.606 -0.684 . . . . 0.0 109.899 169.824 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 31.0 mm -60.35 -29.56 44.48 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 O-C-N 121.503 -0.748 . . . . 0.0 110.767 175.281 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 29.2 m -69.93 -40.74 75.34 Favored 'General case' 0 C--O 1.225 -0.196 0 O-C-N 121.215 -0.928 . . . . 0.0 110.197 173.413 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -56.67 -53.67 54.95 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.571 -0.706 . . . . 0.0 109.576 173.413 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 61.2 mt -63.24 -41.12 99.04 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 121.947 -0.471 . . . . 0.0 111.988 178.437 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.79 -41.26 95.77 Favored Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.737 -0.945 . . . . 0.0 110.737 -179.076 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.34 -46.99 87.93 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.269 0.627 . . . . 0.0 110.127 173.453 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 9.8 tp -51.96 -58.3 6.92 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.714 0.768 . . . . 0.0 109.774 175.402 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -47.83 -53.39 15.72 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 114.486 -1.234 . . . . 0.0 110.089 178.077 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 46.0 ttm -57.59 -51.92 67.51 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 123.684 0.794 . . . . 0.0 111.343 -179.437 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 85.6 mt -61.7 -45.13 99.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.613 -173.712 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.457 0.1 OUTLIER -83.08 -33.99 26.27 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 179.982 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 -84.66 85.57 7.42 Favored 'General case' 0 N--CA 1.463 0.222 0 O-C-N 120.845 -1.159 . . . . 0.0 108.93 173.958 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -36.89 -42.06 0.37 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.654 1.181 . . . . 0.0 113.356 171.741 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -55.33 -17.07 4.12 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 125.298 1.439 . . . . 0.0 114.304 -179.516 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 69.8 mt -108.9 10.14 26.5 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.608 1.163 . . . . 0.0 112.616 -179.114 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 25.9 mmtp -66.72 78.22 0.11 Allowed 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 119.702 1.137 . . . . 0.0 111.77 -179.791 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.239 0 CA-C-O 117.452 -1.749 . . . . 0.0 110.105 177.241 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 57.7 ttp . . . . . 0 N--CA 1.474 0.749 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -74.24 77.87 1.81 Allowed 'General case' 0 C--O 1.235 0.299 0 N-CA-C 110.135 -0.32 . . . . 0.0 110.135 177.958 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -49.54 155.32 1.38 Allowed Pre-proline 0 CA--C 1.535 0.386 0 C-N-CA 125.354 1.462 . . . . 0.0 109.959 172.189 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_exo -43.76 -52.72 5.09 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 123.38 2.72 . . . . 0.0 113.165 -177.141 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.2 mt -55.44 -55.62 29.57 Favored 'General case' 0 C--O 1.226 -0.153 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 173.514 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -58.18 -38.17 76.15 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-N 118.301 0.5 . . . . 0.0 110.332 -175.048 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -68.55 -49.19 61.39 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 125.088 1.355 . . . . 0.0 110.155 -179.313 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.35 -47.39 86.25 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.553 0.741 . . . . 0.0 110.648 177.991 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 70.0 mt -52.48 -53.86 17.9 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 169.956 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.84 -44.24 17.63 Favored Glycine 0 CA--C 1.526 0.736 0 C-N-CA 125.752 1.644 . . . . 0.0 112.322 175.977 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.68 -53.01 62.96 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.809 0.844 . . . . 0.0 110.686 174.683 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 11.0 mp -58.25 -41.43 84.2 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 119.01 0.823 . . . . 0.0 111.395 178.008 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 84.6 mt -60.29 -51.7 69.91 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 123.651 0.78 . . . . 0.0 110.735 174.563 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.48 -49.21 70.74 Favored Glycine 0 CA--C 1.521 0.445 0 N-CA-C 109.685 -1.366 . . . . 0.0 109.685 -179.083 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.2 mm -54.42 -46.41 70.36 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 C-N-CA 123.139 0.576 . . . . 0.0 110.409 174.594 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 58.5 t80 -55.27 -62.65 1.53 Allowed 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 118.974 0.806 . . . . 0.0 109.949 175.205 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -53.15 -38.42 62.72 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.329 1.052 . . . . 0.0 111.66 -175.092 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -47.86 -38.39 16.06 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.059 0.944 . . . . 0.0 111.391 176.986 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -99.35 -59.09 1.79 Allowed 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 177.343 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 4.7 m -51.49 -37.1 47.47 Favored 'General case' 0 C--O 1.227 -0.1 0 C-N-CA 124.215 1.006 . . . . 0.0 112.507 -175.019 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -40.95 -47.47 4.14 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 124.018 0.818 . . . . 0.0 111.728 173.856 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -66.18 -23.07 66.39 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -173.782 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -73.84 -11.56 60.41 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.098 0.559 . . . . 0.0 111.622 179.427 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 76.76 -59.59 3.41 Favored Glycine 0 CA--C 1.529 0.946 0 N-CA-C 110.182 -1.167 . . . . 0.0 110.182 -176.506 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 62.6 t0 -77.81 63.24 2.82 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 171.131 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 63.8 pttt -71.78 7.33 1.57 Allowed 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 114.797 1.406 . . . . 0.0 114.797 -168.523 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 3.8 m80 -77.62 -22.49 50.67 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 168.608 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 2.4 p -122.56 167.32 13.52 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 127.232 2.213 . . . . 0.0 110.381 -179.888 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -152.53 163.52 39.42 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.771 0.829 . . . . 0.0 109.523 167.568 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 14.5 m -84.98 147.17 26.84 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.265 1.026 . . . . 0.0 110.241 176.987 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -53.7 -31.43 47.97 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 -175.176 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.4 tmmt? -50.34 -43.52 54.1 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.884 -0.51 . . . . 0.0 110.184 172.024 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -65.89 -29.68 70.15 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-O 117.847 -1.073 . . . . 0.0 111.794 177.107 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 89.5 mt -65.5 -48.88 71.05 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 120.522 1.51 . . . . 0.0 109.299 174.409 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 59.4 mtmt -60.5 -44.78 95.62 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.228 179.789 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 72.7 mt-10 -55.07 -66.52 0.39 Allowed 'General case' 0 C--O 1.219 -0.536 0 CA-C-O 118.552 -0.737 . . . . 0.0 109.585 170.252 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 9.4 mt -35.93 -60.56 0.53 Allowed 'General case' 0 C--O 1.23 0.065 0 C-N-CA 125.294 1.437 . . . . 0.0 111.475 -179.82 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 1.5 tp -60.36 -51.68 70.16 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.103 -174.605 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -66.07 -44.75 83.6 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.728 0.694 . . . . 0.0 111.986 -175.463 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 6.9 mmpt? -61.87 -58.89 6.21 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 125.4 1.48 . . . . 0.0 109.26 -179.138 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -79.46 -54.76 5.6 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.782 -0.644 . . . . 0.0 109.3 -170.069 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 42.1 mt -83.91 63.15 7.4 Favored 'General case' 0 C--N 1.334 -0.084 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 172.291 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 3.0 t -75.17 55.89 0.77 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.997 0.919 . . . . 0.0 109.435 172.994 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 76.2 mt -74.02 84.41 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 -178.505 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.69 70.55 0.39 Allowed Glycine 0 CA--C 1.531 1.073 0 C-N-CA 124.099 0.857 . . . . 0.0 111.65 177.461 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 19.6 m 140.47 72.32 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 131.518 3.927 . . . . 0.0 106.03 -174.064 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 37.6 mttt -61.67 98.43 0.09 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.201 0.6 . . . . 0.0 111.02 -169.866 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 88.4 mt -40.39 -41.74 1.44 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 127.296 2.238 . . . . 0.0 115.437 -170.466 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -155.13 162.85 40.88 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 105.694 -1.965 . . . . 0.0 105.694 -171.515 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -49.08 -30.63 6.66 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 125.135 1.374 . . . . 0.0 113.524 -175.213 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.25 -66.65 0.09 Allowed 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 126.983 2.113 . . . . 0.0 114.221 -174.732 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -65.34 -39.16 92.03 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-O 121.051 0.453 . . . . 0.0 110.222 -171.024 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 53' ' ' ILE . . . . . 0.647 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.6 mp -64.35 -54.23 33.42 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 -176.946 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 75.6 t -58.09 -44.05 86.55 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.459 0 CA-C-O 118.406 -0.807 . . . . 0.0 110.196 178.794 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -54.92 -52.87 61.6 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 119.528 1.058 . . . . 0.0 110.509 174.396 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 37.0 mt -54.21 -46.18 72.39 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 119.17 -0.443 . . . . 0.0 111.243 179.496 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 26.5 mmt -66.9 -59.24 3.68 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.534 0.683 . . . . 0.0 109.868 179.309 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -48.71 -39.73 25.77 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 126.58 1.952 . . . . 0.0 111.337 -177.079 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -37.6 -50.22 1.14 Allowed 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 126.024 1.73 . . . . 0.0 112.507 -174.195 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 3.1 pp -62.97 -35.57 80.61 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 -175.366 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -85.99 -33.2 21.15 Favored 'General case' 0 C--O 1.224 -0.286 0 C-N-CA 123.184 0.593 . . . . 0.0 110.457 178.512 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 6.6 ttp180 -58.86 -56.62 19.84 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 122.111 0.957 . . . . 0.0 108.603 175.186 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 -84.65 57.24 4.24 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.238 1.015 . . . . 0.0 109.74 -172.73 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 51.2 mttp -55.84 -37.1 68.28 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.274 0.559 . . . . 0.0 110.489 177.554 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -64.08 -11.03 25.95 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.758 1.223 . . . . 0.0 113.081 177.357 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 76.89 -54.72 0.57 Allowed 'General case' 0 C--O 1.233 0.196 0 C-N-CA 126.632 1.973 . . . . 0.0 110.109 -177.707 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -97.15 156.53 16.35 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.445 0.698 . . . . 0.0 110.923 170.541 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 6.0 m -136.88 160.0 36.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 C-N-CA 124.122 0.969 . . . . 0.0 109.471 169.236 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 17.4 p30 -85.94 169.2 13.48 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 125.759 1.623 . . . . 0.0 110.886 174.327 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -39.92 -58.75 1.33 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.982 1.313 . . . . 0.0 113.664 173.932 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 38.4 tp60 -61.76 -40.97 97.0 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 120.786 -1.196 . . . . 0.0 110.981 -174.239 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -68.02 -33.82 75.32 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.78 -0.575 . . . . 0.0 110.862 177.94 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -57.72 -55.09 39.33 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 168.669 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 22.1 mm -52.79 -42.62 42.89 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.212 0 C-N-CA 122.821 0.448 . . . . 0.0 109.95 179.7 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 49.5 m -55.4 -36.29 66.28 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 122.779 0.432 . . . . 0.0 111.376 178.425 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 18.3 t80 -58.46 -53.1 62.09 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 174.969 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 41.8 mt -60.51 -43.07 97.45 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.056 0.542 . . . . 0.0 111.17 178.715 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.23 -46.77 86.05 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 -176.654 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.39 -46.92 88.15 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 117.696 0.748 . . . . 0.0 110.543 175.84 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -51.83 -56.15 15.72 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.766 0.793 . . . . 0.0 109.983 174.426 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.43 -48.98 65.44 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 124.113 0.965 . . . . 0.0 110.474 178.457 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 50.3 ttm -58.3 -49.5 76.93 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.912 0.885 . . . . 0.0 110.971 179.855 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 84.1 mt -64.6 -43.39 96.72 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 CA-C-O 118.186 -0.912 . . . . 0.0 111.233 -175.596 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.445 1.3 p90 -79.43 -40.34 30.18 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.784 1.174 . . . . 0.0 113.607 178.694 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 37.4 m-80 -79.14 70.73 5.56 Favored 'General case' 0 N--CA 1.462 0.136 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 170.567 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -40.89 -41.98 1.73 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.521 1.528 . . . . 0.0 112.6 -174.841 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.29 -54.33 0.4 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.766 1.626 . . . . 0.0 113.044 169.954 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 85.4 mt -66.88 -5.19 11.49 Favored 'General case' 0 C--O 1.225 -0.235 0 C-N-CA 124.146 0.978 . . . . 0.0 113.146 -173.555 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -70.27 -31.82 69.36 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 119.982 1.265 . . . . 0.0 109.741 169.246 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.133 0 CA-C-O 116.932 -2.038 . . . . 0.0 110.912 -177.686 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 92.5 mtp . . . . . 0 N--CA 1.475 0.782 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -78.18 67.85 4.09 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-O 120.862 0.363 . . . . 0.0 110.238 178.809 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 4.2 m -53.35 160.54 1.74 Allowed Pre-proline 0 CA--C 1.536 0.442 0 C-N-CA 124.278 1.031 . . . . 0.0 111.113 175.09 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_exo -43.15 -49.5 7.13 Favored 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 123.528 2.819 . . . . 0.0 113.172 176.28 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.431 HD23 ' HA ' ' A' ' 5' ' ' LEU . 7.3 mt -57.25 -48.5 78.68 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 119.305 -0.379 . . . . 0.0 111.719 174.577 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -59.41 -47.18 86.46 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 118.548 0.613 . . . . 0.0 109.666 -177.081 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 16.0 tt0 -56.08 -52.69 63.38 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.355 0.662 . . . . 0.0 110.375 176.209 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.52 -45.11 84.75 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.383 0.673 . . . . 0.0 112.023 -174.606 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 76.0 mt -55.69 -50.18 69.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 171.534 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.21 -50.03 17.68 Favored Glycine 0 CA--C 1.528 0.863 0 C-N-CA 124.422 1.011 . . . . 0.0 111.488 173.609 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.1 mt -55.83 -56.76 16.77 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 117.586 0.693 . . . . 0.0 111.282 174.848 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -58.32 -44.14 88.51 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 119.257 0.935 . . . . 0.0 111.639 -177.659 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 96.3 mt -56.49 -54.91 22.77 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.2 0 C-N-CA 123.413 0.685 . . . . 0.0 110.198 173.181 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.64 -50.15 58.62 Favored Glycine 0 CA--C 1.523 0.567 0 N-CA-C 110.364 -1.094 . . . . 0.0 110.364 -177.351 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 9.5 mm -54.27 -47.62 68.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 C-N-CA 123.229 0.611 . . . . 0.0 110.107 175.915 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 50.6 t80 -56.1 -59.35 5.05 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.401 0.546 . . . . 0.0 109.998 176.506 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -56.62 -35.47 68.34 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.734 1.214 . . . . 0.0 111.514 -173.732 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -48.88 -36.33 16.81 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.943 0.897 . . . . 0.0 111.779 177.143 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 54.6 m-85 -106.81 -55.73 2.29 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.34 0.656 . . . . 0.0 109.393 178.461 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.9 -32.08 60.7 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 124.103 0.961 . . . . 0.0 111.645 -176.38 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -47.17 -34.23 8.01 Favored Glycine 0 CA--C 1.526 0.769 0 CA-C-O 118.745 -1.031 . . . . 0.0 114.192 179.803 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.93 -1.8 48.47 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 118.48 1.14 . . . . 0.0 113.691 -178.168 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -79.49 132.43 36.33 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 106.011 -1.848 . . . . 0.0 106.011 169.637 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -48.3 -58.08 7.56 Favored Glycine 0 CA--C 1.528 0.898 0 N-CA-C 111.4 -0.68 . . . . 0.0 111.4 -174.657 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -79.96 86.27 5.48 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 106.719 -1.585 . . . . 0.0 106.719 168.758 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 31.6 mtmm -58.58 -15.2 10.4 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.745 1.218 . . . . 0.0 113.501 -174.127 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 16.6 t-160 -75.64 -15.7 60.3 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.117 1.367 . . . . 0.0 110.465 176.135 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.3 p -121.27 149.56 42.7 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 125.196 1.399 . . . . 0.0 111.27 179.286 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -144.46 163.56 33.45 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.573 0.349 . . . . 0.0 111.526 169.709 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 9.7 m -89.36 159.89 17.12 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.095 0.958 . . . . 0.0 113.438 -170.667 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 51.6 pttt -45.99 -42.84 13.64 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 125.272 1.429 . . . . 0.0 112.184 171.793 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 23.2 ttmm -51.97 -50.47 61.2 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 123.483 0.713 . . . . 0.0 110.302 172.815 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 -65.83 -39.99 91.35 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 118.776 -0.631 . . . . 0.0 110.324 -176.897 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 76.0 mt -58.82 -54.97 41.13 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.77 0.713 . . . . 0.0 111.161 173.462 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 61.8 mttm -56.56 -44.27 80.8 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.236 0.614 . . . . 0.0 110.187 -178.422 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -56.81 -67.93 0.27 Allowed 'General case' 0 C--O 1.219 -0.507 0 CA-C-O 118.423 -0.799 . . . . 0.0 109.473 170.555 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.7 mt -34.07 -62.98 0.3 Allowed 'General case' 0 N--CA 1.463 0.209 0 C-N-CA 125.594 1.558 . . . . 0.0 112.132 -178.542 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 18.1 tt -61.26 -48.0 90.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 C-N-CA 120.899 -0.321 . . . . 0.0 110.265 -174.356 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 65.7 tt0 -62.91 -45.55 91.98 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.783 -0.573 . . . . 0.0 111.712 -178.065 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.2 mmpt? -65.07 -58.68 5.44 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 125.397 1.479 . . . . 0.0 109.059 -176.727 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -77.78 -62.36 1.69 Allowed 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.311 -173.226 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 32.8 mt -85.2 61.99 7.22 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 121.394 0.616 . . . . 0.0 109.557 -174.956 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.4 t -75.41 60.37 1.15 Allowed 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 106.278 -1.749 . . . . 0.0 106.278 166.945 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.417 HG23 ' O ' ' A' ' 44' ' ' ILE . 4.8 tt -76.52 81.95 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 C-N-CA 124.011 0.924 . . . . 0.0 110.401 -166.963 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 49.05 50.77 26.93 Favored Glycine 0 CA--C 1.524 0.636 0 C-N-CA 125.339 1.447 . . . . 0.0 112.269 169.932 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.6 m 56.72 44.73 23.11 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.595 0.758 . . . . 0.0 112.052 -176.346 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 62.5 mttm 71.9 62.81 0.14 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.451 1.5 . . . . 0.0 110.875 171.353 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 46.9 mt -35.88 -52.77 0.74 Allowed 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 114.59 1.33 . . . . 0.0 114.59 -177.358 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -150.27 146.91 27.07 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 121.009 0.433 . . . . 0.0 110.703 -170.382 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -25.8 -46.61 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 130.469 3.508 . . . . 0.0 115.207 -176.863 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -31.99 -58.15 0.3 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 125.49 1.516 . . . . 0.0 113.35 176.866 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -65.92 -38.42 88.64 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 121.268 0.556 . . . . 0.0 111.197 -175.289 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.503 ' H ' ' CD1' ' A' ' 53' ' ' ILE . 1.0 OUTLIER -66.06 -50.13 71.55 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 N-CA-C 106.864 -1.532 . . . . 0.0 106.864 -176.157 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 71.6 t -55.49 -54.31 26.87 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 CA-C-O 118.475 -0.774 . . . . 0.0 109.364 174.682 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -47.98 -54.45 12.82 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.629 0.65 . . . . 0.0 110.847 179.332 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 12.8 mt -51.94 -43.35 63.42 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 122.879 0.472 . . . . 0.0 112.197 -177.249 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -78.69 -59.38 2.8 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 122.926 0.49 . . . . 0.0 110.335 -179.661 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -39.71 -37.2 0.49 Allowed 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 126.785 2.034 . . . . 0.0 111.872 176.575 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -36.75 -57.3 0.8 Allowed 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 125.239 1.416 . . . . 0.0 111.408 172.871 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -65.42 -30.75 71.59 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 121.856 -0.527 . . . . 0.0 111.658 -174.346 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -82.1 -36.67 27.33 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.43 0.692 . . . . 0.0 110.523 -175.036 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 13.1 ptt180 -75.06 -44.95 44.68 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 118.813 0.733 . . . . 0.0 109.422 173.714 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -76.45 51.2 0.7 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.119 0.968 . . . . 0.0 110.535 178.679 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 53.2 mttp -58.45 -44.07 89.05 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.38 -0.825 . . . . 0.0 108.968 177.132 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -84.35 23.2 1.13 Allowed 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.158 0.983 . . . . 0.0 111.609 175.874 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 71.8 -49.7 0.69 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 126.298 1.839 . . . . 0.0 114.183 174.019 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -99.89 159.89 14.73 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 -177.182 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.7 m -134.37 159.43 42.01 Favored 'Isoleucine or valine' 0 C--O 1.232 0.159 0 C-N-CA 126.224 1.81 . . . . 0.0 107.805 169.406 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -91.44 174.26 7.47 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 123.612 0.765 . . . . 0.0 111.59 175.798 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 49.3 t80 -42.31 -63.46 0.75 Allowed 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.376 1.07 . . . . 0.0 112.84 173.839 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -61.64 -35.25 77.38 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 120.329 1.422 . . . . 0.0 111.694 -176.179 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -63.6 -41.4 98.32 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 119.836 1.198 . . . . 0.0 111.315 174.33 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -55.04 -51.63 65.69 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 121.01 -1.056 . . . . 0.0 109.608 169.853 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 23.8 mm -55.97 -36.13 43.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 C-N-CA 122.804 0.442 . . . . 0.0 110.245 176.395 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 56.8 m -67.2 -34.48 77.6 Favored 'General case' 0 C--O 1.225 -0.223 0 O-C-N 121.302 -0.874 . . . . 0.0 110.635 177.06 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -53.91 -54.48 38.2 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 169.813 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 59.6 mt -64.2 -41.36 97.11 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.306 0.642 . . . . 0.0 112.034 -178.254 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -70.16 -44.46 60.27 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.416 -1.073 . . . . 0.0 110.416 -176.689 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.08 -49.58 76.74 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 122.171 -0.605 . . . . 0.0 109.754 174.393 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 11.1 tp -48.45 -59.27 3.61 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.464 0.65 . . . . 0.0 109.988 173.922 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -49.64 -53.02 26.59 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.804 1.242 . . . . 0.0 110.581 179.773 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 14.2 ttp -67.1 -36.61 82.31 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 123.357 0.663 . . . . 0.0 111.92 -175.166 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.93 -59.39 4.35 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 CA-C-N 118.791 0.723 . . . . 0.0 109.52 175.679 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.417 0.3 OUTLIER -70.91 -38.33 72.95 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 118.512 -1.275 . . . . 0.0 112.424 -174.21 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -81.78 67.68 7.85 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 120.545 -1.347 . . . . 0.0 107.639 168.994 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -41.24 -40.13 1.53 Allowed 'General case' 0 N--CA 1.462 0.155 0 C-N-CA 125.767 1.627 . . . . 0.0 112.293 -175.242 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -34.55 -53.28 0.52 Allowed 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 125.352 1.461 . . . . 0.0 113.037 172.401 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 90.9 mt -61.0 -15.52 32.71 Favored 'General case' 0 C--O 1.225 -0.23 0 N-CA-C 113.156 0.798 . . . . 0.0 113.156 -174.226 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -66.18 -28.82 69.06 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.751 1.159 . . . . 0.0 111.404 175.079 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.345 0 CA-C-O 117.225 -1.875 . . . . 0.0 111.857 -174.234 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 3.2 mpp? . . . . . 0 N--CA 1.471 0.583 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -76.21 69.89 2.79 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 177.195 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 11.9 m -53.8 159.7 2.51 Favored Pre-proline 0 CA--C 1.537 0.479 0 C-N-CA 123.741 0.816 . . . . 0.0 111.147 176.512 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_exo -42.11 -48.83 6.19 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 123.868 3.045 . . . . 0.0 113.507 177.645 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 6.3 mt -54.25 -51.11 65.55 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 119.564 -0.255 . . . . 0.0 111.521 174.051 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -62.99 -40.46 97.8 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 118.254 0.479 . . . . 0.0 110.144 -175.674 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.7 tp60 -63.9 -46.35 85.24 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 122.512 -0.118 . . . . 0.0 110.96 176.391 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.31 -46.01 88.71 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.593 0.757 . . . . 0.0 110.819 -179.313 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 63.0 mt -52.84 -53.23 22.27 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.254 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 169.678 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.77 -46.66 18.86 Favored Glycine 0 CA--C 1.528 0.854 0 C-N-CA 125.164 1.364 . . . . 0.0 112.05 175.422 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 mt -58.09 -54.19 49.81 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 117.71 0.755 . . . . 0.0 111.166 174.534 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 9.9 mp -57.91 -42.78 85.49 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 118.791 0.723 . . . . 0.0 111.407 179.323 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 85.9 mt -56.4 -56.13 15.27 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.401 0 C-N-CA 123.629 0.772 . . . . 0.0 109.669 173.316 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.2 -48.8 62.23 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.749 -0.94 . . . . 0.0 110.749 -177.754 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 9.1 mm -56.44 -47.23 81.93 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 175.978 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -55.99 -60.81 2.94 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 118.626 0.648 . . . . 0.0 109.923 176.484 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -43.32 -50.1 6.73 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 128.168 2.587 . . . . 0.0 110.467 -177.992 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -48.38 -36.84 15.41 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.583 1.153 . . . . 0.0 112.355 178.266 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 -119.48 36.12 4.6 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.124 0.97 . . . . 0.0 111.236 179.875 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 19.9 p -159.83 -64.47 0.07 Allowed 'General case' 0 N--CA 1.466 0.372 0 O-C-N 121.309 -0.869 . . . . 0.0 109.793 172.505 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -61.24 72.02 0.01 OUTLIER Glycine 0 CA--C 1.522 0.514 0 C-N-CA 127.051 2.263 . . . . 0.0 111.87 177.248 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 11.2 ptmm? -165.83 -122.55 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 125.36 1.464 . . . . 0.0 107.332 176.13 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -76.06 62.58 1.69 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.436 1.095 . . . . 0.0 110.666 -177.075 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 177.71 -177.3 48.33 Favored Glycine 0 CA--C 1.525 0.676 0 O-C-N 121.74 -0.6 . . . . 0.0 112.151 179.679 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -77.91 79.95 4.37 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 -178.523 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 34.6 mttp -29.77 -30.55 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 130.768 3.627 . . . . 0.0 117.849 -171.67 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 20.1 t-160 -76.17 -13.35 60.19 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.546 1.138 . . . . 0.0 111.358 179.275 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 73.4 p -128.33 164.81 21.83 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 124.819 1.248 . . . . 0.0 112.393 -173.136 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 3.4 pp -156.49 178.18 10.61 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.88 1.672 . . . . 0.0 107.225 169.78 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 61.8 p -123.46 177.03 5.82 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 119.326 0.966 . . . . 0.0 112.43 -177.369 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 7.0 ptpp? -40.3 -46.88 2.4 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 125.475 1.51 . . . . 0.0 112.945 175.659 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -62.59 -42.64 99.68 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -176.3 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -67.58 -41.44 84.12 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.301 178.182 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 13.7 mt -58.98 -48.89 79.95 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 119.424 1.011 . . . . 0.0 111.107 175.23 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -57.22 -50.52 72.62 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 178.341 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 64.2 mt-10 -50.8 -62.25 1.72 Allowed 'General case' 0 C--O 1.223 -0.334 0 CA-C-O 119.432 -0.318 . . . . 0.0 110.359 173.619 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 12.3 mt -43.1 -64.86 0.56 Allowed 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.86 1.264 . . . . 0.0 110.841 179.573 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 13.8 tt -61.66 -47.73 91.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 C-N-CA 120.452 -0.499 . . . . 0.0 110.382 -171.456 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -67.37 -49.38 64.19 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 118.271 0.487 . . . . 0.0 111.819 -176.009 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.15 -55.38 16.65 Favored 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 -178.054 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -73.03 -51.21 19.05 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 122.354 -0.216 . . . . 0.0 110.43 -172.211 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 96.0 mt -102.41 63.53 0.88 Allowed 'General case' 0 C--O 1.226 -0.139 0 CA-C-O 121.205 0.526 . . . . 0.0 111.099 -174.043 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 12.0 p -60.97 -39.61 90.24 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 165.569 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . 0.26 11.0 tt 51.19 52.57 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.262 0 C-N-CA 127.593 2.357 . . . . 0.0 110.046 169.616 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.16 -74.96 0.81 Allowed Glycine 0 CA--C 1.525 0.666 0 N-CA-C 109.05 -1.62 . . . . 0.0 109.05 -172.422 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 17.7 m -166.46 74.07 0.16 Allowed 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 125.345 1.458 . . . . 0.0 109.354 176.41 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 47' ' ' LYS . . . . . 0.443 ' HB3' HD11 ' B' ' 53' ' ' ILE . 68.8 mttm 51.68 66.4 1.21 Allowed 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 168.887 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 18.0 mt -65.6 96.56 0.27 Allowed 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.928 -0.482 . . . . 0.0 111.034 -177.338 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 tm0? 79.59 152.75 0.12 Allowed 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.921 1.688 . . . . 0.0 110.92 171.376 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -39.84 -38.36 0.66 Allowed 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 126.649 1.98 . . . . 0.0 114.66 -170.726 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.68 -60.63 0.15 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.999 1.72 . . . . 0.0 114.264 -179.198 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -65.59 -38.69 90.23 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 121.306 0.574 . . . . 0.0 111.307 -174.058 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 53' ' ' ILE . . . . . 0.624 HD12 ' H ' ' B' ' 53' ' ' ILE . 2.4 mp -67.69 -52.97 34.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.548 0 N-CA-C 106.597 -1.631 . . . . 0.0 106.597 -176.443 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 55.4 t -49.18 -48.92 17.41 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 C-N-CA 125.003 1.321 . . . . 0.0 109.645 173.467 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -57.67 -50.02 74.56 Favored 'General case' 0 N--CA 1.457 -0.111 0 CA-C-N 118.577 0.626 . . . . 0.0 111.119 177.708 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 23.9 mt -54.74 -36.6 64.96 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 119.111 -0.471 . . . . 0.0 111.487 177.381 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 28.1 mmt -70.1 -59.52 2.85 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 118.963 0.801 . . . . 0.0 109.838 174.676 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 81.0 m-20 -45.55 -37.39 5.4 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 126.549 1.94 . . . . 0.0 111.27 -178.483 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -38.08 -51.9 1.41 Allowed 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 126.039 1.736 . . . . 0.0 111.029 176.398 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -59.77 -47.42 85.74 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 122.702 0.401 . . . . 0.0 110.35 -177.864 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -63.1 -53.96 45.41 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 122.703 0.401 . . . . 0.0 110.072 -179.418 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 61.4 mtp180 -54.98 -41.86 71.73 Favored 'General case' 0 N--CA 1.456 -0.157 0 O-C-N 121.955 -0.466 . . . . 0.0 110.301 179.897 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 12.5 m120 -87.35 30.62 0.78 Allowed 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 179.098 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 40.5 mtpt -57.54 -39.13 75.94 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 166.278 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -73.63 6.76 2.86 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.555 1.142 . . . . 0.0 112.803 173.398 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 70.91 -55.24 0.65 Allowed 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 127.013 2.125 . . . . 0.0 113.152 179.34 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -101.65 156.29 17.58 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.534 1.134 . . . . 0.0 110.74 178.325 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 10.1 m -130.92 158.63 43.26 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 C-N-CA 126.686 1.995 . . . . 0.0 106.666 168.849 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -99.81 175.2 5.87 Favored 'General case' 0 N--CA 1.462 0.13 0 C-N-CA 124.053 0.941 . . . . 0.0 111.13 177.688 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -40.96 -63.83 0.62 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.239 1.015 . . . . 0.0 112.61 172.38 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 50.9 tp60 -61.52 -36.34 80.28 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 119.59 1.087 . . . . 0.0 111.711 -174.842 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -62.7 -43.01 99.9 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.374 -0.829 . . . . 0.0 110.775 175.62 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -56.29 -51.29 68.71 Favored 'General case' 0 CA--C 1.535 0.403 0 O-C-N 121.838 -0.539 . . . . 0.0 109.884 170.975 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 27.5 mm -55.58 -37.57 46.4 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 O-C-N 121.959 -0.463 . . . . 0.0 110.289 177.554 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 47.8 m -64.76 -37.11 86.51 Favored 'General case' 0 CA--C 1.529 0.139 0 O-C-N 121.682 -0.636 . . . . 0.0 110.603 175.95 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -55.82 -52.98 62.14 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 173.663 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 54.6 mt -62.29 -44.69 95.94 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.55 179.377 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -60.99 -47.91 88.9 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 110.681 -0.968 . . . . 0.0 110.681 -178.901 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.16 -41.22 94.9 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 122.147 -0.619 . . . . 0.0 110.407 177.433 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 23.0 tp -54.04 -56.82 14.36 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 118.636 0.653 . . . . 0.0 109.688 174.611 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -48.58 -50.92 30.36 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 124.524 1.129 . . . . 0.0 109.989 175.891 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 44.7 ttm -58.15 -49.11 78.12 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.209 0.604 . . . . 0.0 111.669 -179.078 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 81.1 mt -65.27 -51.12 68.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.67 -176.033 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.45 0.1 OUTLIER -76.34 -38.64 55.63 Favored 'General case' 0 C--N 1.345 0.392 0 CA-C-N 119.678 1.127 . . . . 0.0 112.958 -177.153 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 23.2 m-80 -82.93 68.57 9.47 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 169.33 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 87.8 mt-10 -41.56 -38.57 1.37 Allowed 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 125.749 1.619 . . . . 0.0 112.688 -173.309 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -35.44 -53.97 0.66 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.046 1.338 . . . . 0.0 112.768 171.583 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 92.3 mt -64.98 -7.1 10.27 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.037 0.935 . . . . 0.0 113.347 -174.46 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -67.29 -32.95 74.29 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 120.059 1.3 . . . . 0.0 110.484 170.45 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.083 0 CA-C-O 117.69 -1.617 . . . . 0.0 111.995 -172.838 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.262 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -56.57 165.04 1.76 Allowed Pre-proline 0 CA--C 1.538 0.499 0 C-N-CA 124.651 1.18 . . . . 0.0 111.461 -179.556 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -44.03 -48.49 9.32 Favored 'Trans proline' 0 N--CA 1.458 -0.563 0 C-N-CA 123.805 3.004 . . . . 0.0 113.535 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.1 mt -53.39 -56.7 14.59 Favored 'General case' 0 C--O 1.226 -0.173 0 CA-C-N 117.66 0.209 . . . . 0.0 111.47 173.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -59.82 -41.78 92.05 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -174.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 tp-100 -60.47 -50.13 74.81 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.619 0.767 . . . . 0.0 110.437 176.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.31 -44.77 94.02 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.331 0.652 . . . . 0.0 111.213 -178.28 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 74.1 mt -52.41 -53.01 21.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 169.676 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.55 -47.97 17.24 Favored Glycine 0 CA--C 1.528 0.85 0 C-N-CA 125.254 1.406 . . . . 0.0 112.029 174.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 mt -56.77 -55.9 28.39 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 117.904 0.852 . . . . 0.0 111.051 174.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -56.92 -42.61 80.3 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 119.152 0.887 . . . . 0.0 111.318 -179.127 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 87.3 mt -57.11 -54.42 30.46 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 C-N-CA 123.305 0.642 . . . . 0.0 110.843 172.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.91 -49.87 64.32 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.211 -1.155 . . . . 0.0 110.211 -177.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 12.5 mm -52.48 -50.14 40.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 C-N-CA 124.027 0.931 . . . . 0.0 110.067 175.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -53.79 -62.29 1.75 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 121.346 0.593 . . . . 0.0 109.822 176.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -55.39 -35.12 64.98 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.001 0.92 . . . . 0.0 111.873 -173.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -48.7 -36.3 15.87 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.886 0.874 . . . . 0.0 111.659 176.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 56.3 m-85 -103.61 -56.43 2.21 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 123.125 0.57 . . . . 0.0 109.756 176.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.0 m . . . . . 0 C--O 1.227 -0.08 0 C-N-CA 123.533 0.733 . . . . 0.0 111.93 -176.792 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 69.5 p . . . . . 0 N--CA 1.452 -0.374 0 CA-C-O 120.884 0.373 . . . . 0.0 110.815 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.83 -171.73 3.21 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 125.952 1.701 . . . . 0.0 107.556 168.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 92.2 p -145.49 177.0 9.17 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 119.589 1.086 . . . . 0.0 112.672 -176.156 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -18.61 -64.64 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 130.919 3.687 . . . . 0.0 113.257 172.402 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.09 -53.23 59.57 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 123.918 0.887 . . . . 0.0 111.201 -178.016 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -61.87 -38.08 86.95 Favored 'General case' 0 C--O 1.222 -0.357 0 C-N-CA 123.077 0.551 . . . . 0.0 110.424 179.481 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 43.7 mt -64.81 -48.78 73.17 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 118.676 0.671 . . . . 0.0 110.979 178.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -57.69 -47.9 81.04 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 110.218 -0.29 . . . . 0.0 110.218 175.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -52.14 -59.14 4.72 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-O 119.396 -0.335 . . . . 0.0 110.695 172.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.3 mt -45.01 -61.53 1.59 Allowed 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 124.771 1.228 . . . . 0.0 110.551 -178.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 12.5 tt -62.08 -51.55 71.07 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 119.983 -0.687 . . . . 0.0 109.717 -174.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -61.88 -44.8 96.07 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.8 -0.562 . . . . 0.0 112.263 -174.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -75.12 -58.28 3.38 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 -177.545 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 18.0 mp0 -77.66 -18.82 56.32 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 117.634 -1.174 . . . . 0.0 113.305 -168.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 67.0 mt . . . . . 0 C--N 1.34 0.177 0 CA-C-N 120.133 1.333 . . . . 0.0 107.639 167.259 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 23.0 t70 . . . . . 0 CA--C 1.521 -0.15 0 N-CA-C 109.826 -0.435 . . . . 0.0 109.826 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -34.89 -63.21 0.33 Allowed 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 125.144 1.378 . . . . 0.0 112.796 -178.074 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 67.4 tt0 -62.9 -37.01 85.22 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.327 0.651 . . . . 0.0 111.456 -174.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.495 ' CD1' ' H ' ' A' ' 53' ' ' ILE . 0.9 OUTLIER -62.37 -53.99 40.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 N-CA-C 105.868 -1.901 . . . . 0.0 105.868 -179.193 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 75.1 t -57.15 -41.19 77.36 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.606 0 CA-C-O 118.035 -0.983 . . . . 0.0 110.498 177.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.6 mmmt -58.18 -51.7 68.66 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 120.167 1.349 . . . . 0.0 110.192 176.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 49.5 mt -55.73 -43.77 76.9 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 119.162 -0.447 . . . . 0.0 110.925 179.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 22.1 mmt -67.15 -60.75 2.35 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 118.807 0.73 . . . . 0.0 109.624 178.466 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -42.73 -45.56 4.8 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 126.746 2.018 . . . . 0.0 111.213 -178.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -39.41 -47.79 1.84 Allowed 'General case' 0 C--O 1.234 0.252 0 C-N-CA 124.578 1.151 . . . . 0.0 112.36 178.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -57.99 -48.22 80.64 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-O 119.456 -0.307 . . . . 0.0 110.345 -178.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -71.02 -49.05 49.26 Favored 'General case' 0 C--O 1.227 -0.126 0 CA-C-N 118.14 0.427 . . . . 0.0 110.335 -178.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 54.5 ttt85 . . . . . 0 N--CA 1.456 -0.175 0 C-N-CA 124.788 1.235 . . . . 0.0 110.613 -178.97 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 22.2 mp0 . . . . . 0 CA--C 1.533 0.323 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.2 m -108.39 149.44 11.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 169.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 17.9 p30 -88.69 170.66 10.61 Favored 'General case' 0 C--O 1.23 0.077 0 C-N-CA 124.325 1.05 . . . . 0.0 110.832 175.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -38.58 -61.42 0.71 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.83 1.252 . . . . 0.0 113.74 174.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 40.8 tp60 -62.66 -38.75 91.54 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 120.025 1.284 . . . . 0.0 110.669 -174.433 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.85 -33.5 75.98 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.888 -0.507 . . . . 0.0 110.947 176.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -61.18 -53.27 59.11 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 118.841 0.746 . . . . 0.0 109.182 168.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 24.2 mm -52.24 -42.54 37.0 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 C-N-CA 122.844 0.458 . . . . 0.0 110.097 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 34.0 m -54.17 -37.76 64.81 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.049 0.54 . . . . 0.0 111.378 177.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -57.34 -50.18 73.78 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 176.026 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 51.5 mt -65.63 -43.65 88.86 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.186 0.595 . . . . 0.0 111.329 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.63 -43.41 97.97 Favored Glycine 0 CA--C 1.529 0.919 0 N-CA-C 110.945 -0.862 . . . . 0.0 110.945 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.81 -49.84 73.35 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 123.095 0.558 . . . . 0.0 110.383 175.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 16.4 tp -47.37 -56.48 6.81 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.401 0.619 . . . . 0.0 109.948 173.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.96 -53.57 39.77 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.555 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 9.2 mtm -57.46 -50.45 72.99 Favored 'General case' 0 N--CA 1.455 -0.203 0 O-C-N 123.327 0.392 . . . . 0.0 111.861 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 84.0 mt -63.41 -49.96 80.61 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-O 117.79 -1.1 . . . . 0.0 110.34 -174.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.467 0.4 OUTLIER -78.18 -40.36 37.97 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-N 120.256 1.389 . . . . 0.0 113.504 -178.508 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.0 m-80 -82.53 67.22 8.49 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 169.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 90.2 mt-10 -41.37 -42.64 2.29 Favored 'General case' 0 N--CA 1.461 0.099 0 C-N-CA 125.281 1.432 . . . . 0.0 112.12 -172.181 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -31.42 -52.75 0.22 Allowed 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 126.561 1.944 . . . . 0.0 113.372 171.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 63.8 mt . . . . . 0 C--O 1.224 -0.256 0 C-N-CA 123.717 0.807 . . . . 0.0 113.103 -175.157 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.274 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.3 m -57.54 165.91 1.99 Allowed Pre-proline 0 CA--C 1.537 0.477 0 C-N-CA 125.082 1.353 . . . . 0.0 111.109 179.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 99.1 Cg_exo -45.45 -47.53 12.96 Favored 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 123.524 2.816 . . . . 0.0 113.477 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.9 mt -54.39 -55.53 27.7 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-N 117.817 0.28 . . . . 0.0 111.435 173.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -59.43 -39.67 84.27 Favored 'General case' 0 C--O 1.225 -0.22 0 N-CA-C 110.385 -0.228 . . . . 0.0 110.385 -176.021 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 12.4 tp-100 -63.37 -50.41 70.04 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.507 0.723 . . . . 0.0 110.501 177.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.28 -45.03 93.34 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.313 0.645 . . . . 0.0 111.095 -178.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 72.7 mt -53.14 -53.23 23.79 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 N-CA-C 108.107 -1.071 . . . . 0.0 108.107 169.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.43 -45.86 16.82 Favored Glycine 0 CA--C 1.526 0.751 0 C-N-CA 125.69 1.614 . . . . 0.0 112.176 175.328 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.7 mt -57.87 -55.99 27.8 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 117.751 0.776 . . . . 0.0 110.97 173.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.6 mp -58.69 -43.02 89.85 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.18 0.9 . . . . 0.0 111.608 -179.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 75.0 mt -54.12 -57.23 6.34 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 C-N-CA 124.09 0.956 . . . . 0.0 109.981 171.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.02 -50.44 58.91 Favored Glycine 0 CA--C 1.522 0.497 0 N-CA-C 110.249 -1.14 . . . . 0.0 110.249 -176.019 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 13.9 mm -51.56 -50.28 30.55 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 C-N-CA 123.523 0.729 . . . . 0.0 110.04 175.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -56.9 -57.72 11.26 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.252 178.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -56.72 -38.44 72.35 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.843 0.857 . . . . 0.0 111.139 -174.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -46.09 -39.14 8.93 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.601 1.161 . . . . 0.0 111.571 -179.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -107.2 -52.01 2.83 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 122.542 0.337 . . . . 0.0 110.11 178.341 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 5.6 m . . . . . 0 CA--C 1.527 0.081 0 C-N-CA 123.573 0.749 . . . . 0.0 111.981 -177.01 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 19.9 t-160 . . . . . 0 N--CA 1.452 -0.347 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 56.9 p -125.58 157.94 35.88 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 125.162 1.385 . . . . 0.0 111.968 -172.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.88 178.44 9.4 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 125.372 1.469 . . . . 0.0 107.703 168.109 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 4.3 m -135.5 173.31 11.86 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.412 0.685 . . . . 0.0 112.793 -170.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 37.2 ttmt -19.52 -68.86 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 130.44 3.496 . . . . 0.0 113.824 175.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 3.0 tppp? -56.08 -53.55 55.67 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.586 0.755 . . . . 0.0 109.959 -175.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -57.04 -41.71 79.15 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 123.516 0.726 . . . . 0.0 110.989 178.524 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 39.4 mt -61.47 -50.05 74.33 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 118.478 0.581 . . . . 0.0 111.212 178.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -59.55 -47.7 84.51 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 179.227 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -50.71 -55.91 14.42 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.314 0.646 . . . . 0.0 111.403 171.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 3.1 mt -45.43 -65.25 0.56 Allowed 'General case' 0 CA--C 1.521 -0.151 0 C-N-CA 124.514 1.126 . . . . 0.0 110.994 176.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 14.8 tt -61.19 -47.61 92.75 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 C-N-CA 120.056 -0.658 . . . . 0.0 109.827 -173.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -53.94 -50.12 67.16 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.016 0.926 . . . . 0.0 111.866 -178.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 50.9 mtmt -76.21 -49.48 17.04 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 122.359 0.264 . . . . 0.0 111.076 -176.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -78.02 -32.44 51.04 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 118.533 -0.746 . . . . 0.0 112.795 -169.215 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 48.7 mt . . . . . 0 C--N 1.338 0.089 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 169.013 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 . . . . . 0 C--O 1.226 -0.149 0 N-CA-C 113.886 1.069 . . . . 0.0 113.886 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -30.3 -55.7 0.19 Allowed 'General case' 0 C--O 1.227 -0.102 0 C-N-CA 125.907 1.683 . . . . 0.0 113.695 178.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -66.1 -42.17 89.63 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 121.069 0.461 . . . . 0.0 110.701 -174.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 53' ' ' ILE . . . . . 0.558 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.1 mp -61.26 -52.97 55.22 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 N-CA-C 106.636 -1.616 . . . . 0.0 106.636 179.292 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 69.9 t -57.08 -43.72 81.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 C-N-CA 124.362 1.065 . . . . 0.0 110.233 -178.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -55.92 -54.78 40.56 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 119.418 1.008 . . . . 0.0 110.497 172.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 43.5 mt -53.36 -42.09 66.49 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 119.04 -0.505 . . . . 0.0 111.359 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 22.9 mmt -68.76 -61.86 1.63 Allowed 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 118.741 0.701 . . . . 0.0 109.613 177.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -40.94 -46.98 2.92 Favored 'General case' 0 CA--C 1.516 -0.333 0 C-N-CA 127.626 2.37 . . . . 0.0 111.113 -177.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -39.71 -49.22 2.26 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.071 0.949 . . . . 0.0 112.513 177.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 10.0 mp -59.74 -56.02 27.05 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -177.268 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -61.27 -40.87 95.7 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 123.444 0.698 . . . . 0.0 111.245 -178.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 52.5 ttt180 -62.94 -50.54 70.4 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 124.035 0.934 . . . . 0.0 109.798 -178.559 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 . . . . . 0 C--O 1.227 -0.082 0 N-CA-C 110.586 -0.153 . . . . 0.0 110.586 -176.2 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 . . . . . 0 N--CA 1.453 -0.311 0 N-CA-C 110.378 -0.23 . . . . 0.0 110.378 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 12.0 m -115.67 148.03 18.67 Favored 'Isoleucine or valine' 0 C--O 1.235 0.303 0 N-CA-C 107.062 -1.459 . . . . 0.0 107.062 168.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -89.39 177.6 6.54 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.542 0.737 . . . . 0.0 111.287 175.251 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -47.35 -60.02 2.8 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.623 0.769 . . . . 0.0 111.94 175.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 40.3 tp60 -58.9 -37.93 77.75 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 119.218 0.917 . . . . 0.0 111.264 -176.029 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -63.26 -42.79 99.18 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.502 -0.749 . . . . 0.0 111.032 176.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -55.67 -48.59 74.79 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.64 -0.663 . . . . 0.0 109.915 170.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 28.0 mm -59.05 -32.47 47.89 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 O-C-N 121.601 -0.687 . . . . 0.0 110.76 175.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 23.4 m -66.37 -41.75 88.99 Favored 'General case' 0 C--O 1.225 -0.189 0 O-C-N 121.265 -0.897 . . . . 0.0 109.822 174.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -56.3 -52.92 62.74 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 174.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 49.2 mt -60.07 -46.13 90.59 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 120.933 0.397 . . . . 0.0 111.664 177.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.28 -39.2 97.58 Favored Glycine 0 CA--C 1.525 0.662 0 N-CA-C 110.948 -0.861 . . . . 0.0 110.948 -176.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.33 -47.14 77.54 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.431 0.692 . . . . 0.0 110.175 174.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 14.5 tp -51.33 -54.36 27.03 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 175.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.83 -57.33 9.65 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 114.872 -1.058 . . . . 0.0 109.995 177.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 49.5 ttm -48.09 -51.14 25.74 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.785 0.834 . . . . 0.0 110.755 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 33.6 mt -69.91 -48.49 63.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-O 117.859 -1.067 . . . . 0.0 111.201 -172.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.426 0.0 OUTLIER -87.99 -34.74 17.94 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 115.157 1.54 . . . . 0.0 115.157 -176.593 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 33.4 m120 -80.0 68.6 6.16 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 172.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -33.55 -43.79 0.13 Allowed 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 127.725 2.41 . . . . 0.0 114.364 -174.136 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -40.5 -41.5 1.44 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.572 1.549 . . . . 0.0 113.038 176.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 96.0 mt . . . . . 0 CA--C 1.532 0.281 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -179.085 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.215 0 CA-C-O 120.889 0.376 . . . . 0.0 110.892 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -54.86 161.57 2.25 Favored Pre-proline 0 CA--C 1.542 0.636 0 C-N-CA 124.012 0.925 . . . . 0.0 111.093 173.192 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -48.94 -49.26 15.59 Favored 'Trans proline' 0 N--CA 1.458 -0.592 0 C-N-CA 123.009 2.472 . . . . 0.0 112.424 177.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 5' ' ' LEU . 6.6 mt -58.45 -45.54 88.35 Favored 'General case' 0 C--O 1.223 -0.309 0 CA-C-O 118.985 -0.531 . . . . 0.0 111.013 175.484 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -57.86 -46.09 85.33 Favored 'General case' 0 C--O 1.227 -0.111 0 CA-C-N 118.771 0.714 . . . . 0.0 109.758 -178.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 12.5 tp60 -61.17 -49.07 78.71 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 122.05 0.14 . . . . 0.0 111.052 177.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.12 -46.91 79.06 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 121.503 0.668 . . . . 0.0 111.474 -175.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 76.9 mt -53.74 -53.56 25.53 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.233 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 170.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -45.96 -47.41 14.53 Favored Glycine 0 CA--C 1.528 0.857 0 C-N-CA 124.78 1.181 . . . . 0.0 111.807 175.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.2 mt -55.94 -57.18 13.2 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.22 0.608 . . . . 0.0 110.963 173.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.5 mp -57.44 -43.78 84.17 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.26 0.937 . . . . 0.0 111.899 -178.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 63.6 mt -55.01 -57.93 5.61 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 C-N-CA 123.627 0.771 . . . . 0.0 109.814 172.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -53.72 -49.95 55.93 Favored Glycine 0 CA--C 1.522 0.518 0 N-CA-C 110.411 -1.076 . . . . 0.0 110.411 -176.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 11.7 mm -52.62 -49.59 44.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 C-N-CA 123.581 0.752 . . . . 0.0 110.318 175.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -56.72 -57.42 12.5 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 118.307 0.503 . . . . 0.0 110.147 177.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -59.18 -37.09 76.54 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 123.549 0.74 . . . . 0.0 111.388 -172.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -46.64 -40.84 13.76 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 124.738 1.215 . . . . 0.0 111.41 178.22 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -96.55 -59.44 1.82 Allowed 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 176.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.4 m . . . . . 0 CA--C 1.527 0.082 0 C-N-CA 123.984 0.914 . . . . 0.0 112.273 -171.752 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.2 p . . . . . 0 N--CA 1.451 -0.416 0 N-CA-C 110.374 -0.232 . . . . 0.0 110.374 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.34 178.61 9.42 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 125.471 1.509 . . . . 0.0 107.38 168.532 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 7.3 t -134.39 -168.5 2.15 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.462 1.028 . . . . 0.0 113.675 -174.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 21.2 pttt -48.81 -53.3 19.77 Favored 'General case' 0 C--O 1.228 -0.06 0 C-N-CA 126.146 1.778 . . . . 0.0 115.001 -168.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -54.05 -47.69 71.36 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 118.795 0.725 . . . . 0.0 109.961 179.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -63.03 -39.93 96.21 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 123.281 0.632 . . . . 0.0 110.79 178.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.1 mp -61.6 -49.08 78.03 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.901 0.773 . . . . 0.0 112.192 174.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -56.02 -47.79 77.16 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 176.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -54.78 -57.04 13.13 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-O 119.148 -0.453 . . . . 0.0 111.168 173.232 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.6 mt -46.42 -60.49 2.31 Favored 'General case' 0 C--N 1.333 -0.136 0 C-N-CA 123.836 0.854 . . . . 0.0 110.333 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 13.5 tt -62.72 -50.86 78.03 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 C-N-CA 120.44 -0.504 . . . . 0.0 109.879 -176.034 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -59.94 -47.42 85.85 Favored 'General case' 0 CA--C 1.537 0.471 0 O-C-N 121.152 -0.967 . . . . 0.0 112.235 -175.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -76.13 -55.93 5.13 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.819 -0.551 . . . . 0.0 109.707 -177.356 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -84.77 -19.38 32.68 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 -168.194 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 30.3 mt . . . . . 0 N--CA 1.461 0.096 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 169.328 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.0 t70 . . . . . 0 CA--C 1.521 -0.137 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -36.13 -58.99 0.64 Allowed 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 125.078 1.351 . . . . 0.0 112.581 -179.504 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 87.7 tt0 -61.4 -39.76 91.89 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.942 0.897 . . . . 0.0 111.388 -176.42 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.467 ' CD1' ' H ' ' A' ' 53' ' ' ILE . 0.9 OUTLIER -65.2 -54.58 27.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 106.45 -1.685 . . . . 0.0 106.45 -176.552 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 78.5 t -56.76 -42.18 76.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.046 177.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.8 mptp? -55.89 -54.31 46.24 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 119.091 0.86 . . . . 0.0 110.607 175.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 27.5 mt -53.26 -39.3 63.78 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 119.369 -0.348 . . . . 0.0 111.503 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.89 -62.66 1.42 Allowed 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 118.537 0.608 . . . . 0.0 110.078 177.208 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -43.33 -40.14 3.45 Favored 'General case' 0 CA--C 1.523 -0.074 0 C-N-CA 127.062 2.145 . . . . 0.0 111.987 -178.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -39.81 -47.82 2.17 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.303 1.041 . . . . 0.0 112.736 173.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.8 mp -66.49 -34.15 77.28 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 122.898 0.479 . . . . 0.0 110.901 -179.011 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -74.41 -51.93 13.56 Favored 'General case' 0 N--CA 1.456 -0.128 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 -179.188 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 17.4 mtp85 . . . . . 0 CA--C 1.531 0.241 0 C-N-CA 123.624 0.77 . . . . 0.0 109.231 170.101 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 . . . . . 0 N--CA 1.45 -0.47 0 N-CA-C 105.11 -2.182 . . . . 0.0 105.11 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 11.6 m -86.34 135.59 24.73 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 -178.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -79.8 171.03 15.67 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 123.731 0.812 . . . . 0.0 111.027 176.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -42.51 -59.52 1.85 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.502 0.721 . . . . 0.0 112.831 176.065 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.2 tp60 -63.85 -33.52 75.87 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 120.9 -1.125 . . . . 0.0 111.113 -175.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -64.81 -41.84 95.47 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 121.385 -0.822 . . . . 0.0 110.779 174.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -55.94 -50.59 70.35 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.414 -0.804 . . . . 0.0 109.38 170.242 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.1 mm -56.66 -37.94 55.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 O-C-N 121.922 -0.486 . . . . 0.0 110.451 176.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 33.2 m -62.63 -39.44 93.85 Favored 'General case' 0 C--O 1.226 -0.137 0 CA-C-N 118.95 0.796 . . . . 0.0 110.013 176.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -55.19 -53.97 49.22 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 173.004 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 53.5 mt -60.91 -45.16 95.74 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 122.04 -0.413 . . . . 0.0 112.017 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.35 -45.34 91.08 Favored Glycine 0 CA--C 1.524 0.616 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 -176.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.51 -45.51 92.66 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 117.691 0.745 . . . . 0.0 110.187 175.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 12.7 tp -51.87 -56.02 16.55 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 118.488 0.585 . . . . 0.0 109.786 174.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.06 -53.32 34.86 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.332 1.053 . . . . 0.0 110.669 178.381 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 44.6 ttm -55.55 -50.76 69.18 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 125.082 1.353 . . . . 0.0 110.757 -179.05 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 62.8 mt -65.92 -53.34 39.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-O 118.454 -0.784 . . . . 0.0 110.265 -175.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.473 0.1 OUTLIER -74.54 -37.55 63.01 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-N 119.739 1.154 . . . . 0.0 113.126 -176.057 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 25.0 m-80 -82.66 61.55 5.82 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 168.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.71 -37.06 3.46 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.88 1.272 . . . . 0.0 112.332 -174.518 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -31.96 -48.36 0.16 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 127.699 2.4 . . . . 0.0 113.306 169.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 46.2 mt . . . . . 0 CA--C 1.529 0.148 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 -177.193 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.227 0 CA-C-O 121.779 0.8 . . . . 0.0 110.746 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 10.5 m -62.76 163.5 15.62 Favored Pre-proline 0 CA--C 1.538 0.484 0 C-N-CA 125.871 1.668 . . . . 0.0 109.206 178.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -48.14 -48.33 16.92 Favored 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 122.921 2.414 . . . . 0.0 113.006 -176.521 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.8 mt -53.73 -52.54 59.81 Favored 'General case' 0 C--O 1.225 -0.192 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 172.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -61.57 -38.74 88.62 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-N 118.063 0.392 . . . . 0.0 110.565 -176.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.2 tp-100 -62.82 -50.9 69.16 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.291 0.636 . . . . 0.0 110.213 176.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.67 -45.93 91.89 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.44 0.638 . . . . 0.0 111.193 -179.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 67.4 mt -53.44 -51.24 43.33 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 170.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -48.59 -47.73 29.38 Favored Glycine 0 CA--C 1.525 0.713 0 C-N-CA 125.359 1.456 . . . . 0.0 111.619 175.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 mt -54.88 -55.21 32.95 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 117.525 0.662 . . . . 0.0 110.651 173.137 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -57.07 -43.6 82.26 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.007 0.822 . . . . 0.0 111.616 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 94.6 mt -56.07 -55.55 17.76 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 C-N-CA 123.487 0.715 . . . . 0.0 110.091 173.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.09 -48.49 73.52 Favored Glycine 0 CA--C 1.523 0.588 0 N-CA-C 110.802 -0.919 . . . . 0.0 110.802 -178.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.5 mm -53.58 -47.53 60.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 C-N-CA 123.183 0.593 . . . . 0.0 110.011 175.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -56.36 -57.37 12.55 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.476 0.58 . . . . 0.0 109.543 175.048 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -52.49 -40.17 62.06 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 125.491 1.516 . . . . 0.0 112.113 -173.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 65.0 tttp -50.96 -34.71 29.98 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.128 1.371 . . . . 0.0 111.467 176.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 71.5 m-85 -101.96 -60.89 1.46 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.615 0.766 . . . . 0.0 110.806 179.103 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 5.0 p . . . . . 0 C--O 1.224 -0.246 0 C-N-CA 123.335 0.654 . . . . 0.0 110.743 -174.528 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 9.5 t-80 . . . . . 0 C--O 1.235 0.313 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 4.8 p -136.58 162.46 33.06 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.898 0.879 . . . . 0.0 112.89 -168.195 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -161.34 174.24 13.81 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.695 1.198 . . . . 0.0 109.255 168.103 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -115.41 171.83 7.47 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.054 0.941 . . . . 0.0 112.832 -169.662 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 14.3 ptmt -35.93 -57.98 0.66 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 127.521 2.328 . . . . 0.0 114.414 179.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.17 -45.43 87.49 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 122.805 0.442 . . . . 0.0 110.118 -178.144 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -62.87 -39.42 94.39 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 123.299 0.64 . . . . 0.0 110.936 177.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 5.9 mt -61.41 -49.82 75.31 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 119.096 0.862 . . . . 0.0 111.849 173.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 89.3 mttt -55.52 -46.84 76.98 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 122.114 -0.366 . . . . 0.0 110.266 176.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -54.62 -55.06 33.4 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 118.856 -0.592 . . . . 0.0 110.915 173.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 8.3 mt -46.38 -61.38 1.82 Allowed 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.295 0.638 . . . . 0.0 110.43 179.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 18.4 tt -59.62 -54.5 33.71 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 119.916 -0.713 . . . . 0.0 110.156 -176.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -60.79 -46.11 91.79 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 118.606 0.639 . . . . 0.0 112.673 -173.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -74.8 -52.75 10.62 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.13 0.572 . . . . 0.0 109.626 -177.474 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 55.4 mm-40 -81.96 -27.52 33.21 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -167.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 41.0 mt . . . . . 0 CA--C 1.523 -0.083 0 N-CA-C 105.114 -2.18 . . . . 0.0 105.114 167.438 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 19.8 t70 . . . . . 0 CA--C 1.529 0.137 0 N-CA-C 115.367 1.617 . . . . 0.0 115.367 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.84 -60.97 0.16 Allowed 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 125.912 1.685 . . . . 0.0 113.35 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -66.15 -39.83 90.11 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 120.792 0.33 . . . . 0.0 110.954 -174.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 53' ' ' ILE . . . . . 0.478 ' H ' ' CD1' ' B' ' 53' ' ' ILE . 0.9 OUTLIER -61.06 -57.6 11.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 -177.937 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 52.5 t -57.77 -39.39 70.48 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 CA-C-N 115.01 -0.995 . . . . 0.0 110.187 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -56.17 -52.14 65.45 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 119.794 1.179 . . . . 0.0 111.229 174.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 68.1 mt -55.38 -40.54 71.48 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 119.345 -0.359 . . . . 0.0 111.205 -179.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.47 -60.69 2.1 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 118.839 0.745 . . . . 0.0 110.132 176.366 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -40.46 -46.13 2.37 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 127.369 2.268 . . . . 0.0 111.7 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -39.55 -48.23 2.02 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.449 1.1 . . . . 0.0 112.112 175.423 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 63.2 mt -57.9 -50.83 72.0 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.508 0.723 . . . . 0.0 110.017 -179.232 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -67.21 -41.16 86.23 Favored 'General case' 0 C--O 1.226 -0.15 0 C-N-CA 123.194 0.598 . . . . 0.0 111.067 -178.38 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 53.3 ttm-85 -60.01 -48.21 82.64 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.464 1.106 . . . . 0.0 109.977 -179.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 . . . . . 0 C--O 1.228 -0.051 0 CA-C-O 120.703 0.287 . . . . 0.0 111.316 -177.537 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 44.9 mp0 . . . . . 0 N--CA 1.451 -0.413 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 35.6 m -86.27 154.94 3.38 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 168.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 16.3 p30 -97.93 171.13 8.48 Favored 'General case' 0 CA--C 1.528 0.111 0 C-N-CA 124.797 1.239 . . . . 0.0 111.425 176.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -41.59 -60.98 1.16 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.402 1.081 . . . . 0.0 113.16 175.083 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 41.1 tp60 -63.51 -34.0 76.82 Favored 'General case' 0 C--O 1.225 -0.211 0 O-C-N 121.036 -1.04 . . . . 0.0 110.879 -175.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 54.7 mm-40 -63.01 -45.43 92.4 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 118.932 0.787 . . . . 0.0 111.17 173.225 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -53.67 -50.03 66.7 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.697 -0.627 . . . . 0.0 109.846 171.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 27.1 mm -58.01 -38.42 66.92 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 O-C-N 121.855 -0.528 . . . . 0.0 110.652 176.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 70.7 m -63.11 -41.71 99.4 Favored 'General case' 0 C--O 1.226 -0.174 0 O-C-N 121.506 -0.746 . . . . 0.0 109.972 176.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -56.37 -54.28 47.48 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 174.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 42.2 mt -58.82 -47.65 84.04 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 121.975 -0.453 . . . . 0.0 112.032 178.639 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.75 -43.94 97.02 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 110.87 -0.892 . . . . 0.0 110.87 -176.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.07 -48.26 79.42 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 121.988 -0.713 . . . . 0.0 110.205 176.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -49.56 -56.83 8.53 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-O 121.864 0.84 . . . . 0.0 109.88 173.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.94 -54.54 23.37 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 114.612 -1.176 . . . . 0.0 110.376 179.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 19.7 ttp -62.4 -45.57 92.52 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 123.596 0.758 . . . . 0.0 111.648 -177.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 75.4 mt -60.66 -47.88 91.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.012 -177.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.484 0.0 OUTLIER -82.45 -34.16 28.25 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 114.476 1.287 . . . . 0.0 114.476 -179.926 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -80.6 75.05 7.5 Favored 'General case' 0 N--CA 1.462 0.159 0 O-C-N 120.779 -1.201 . . . . 0.0 108.505 171.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -40.41 -37.99 0.76 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.834 1.654 . . . . 0.0 112.977 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -39.93 -42.3 1.32 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.527 1.531 . . . . 0.0 113.46 173.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 93.9 mt . . . . . 0 CA--C 1.533 0.319 0 C-N-CA 123.763 0.825 . . . . 0.0 113.029 -176.956 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.237 0 CA-C-O 121.222 0.534 . . . . 0.0 111.972 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -50.32 158.33 1.03 Allowed Pre-proline 0 CA--C 1.54 0.586 0 C-N-CA 124.702 1.201 . . . . 0.0 111.541 177.314 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_exo -44.67 -49.89 8.89 Favored 'Trans proline' 0 N--CA 1.46 -0.491 0 C-N-CA 123.501 2.801 . . . . 0.0 113.404 -179.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.407 HD23 ' HA ' ' A' ' 5' ' ' LEU . 6.2 mt -55.9 -48.96 74.71 Favored 'General case' 0 C--O 1.226 -0.164 0 O-C-N 122.427 -0.17 . . . . 0.0 111.316 174.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -59.77 -46.9 87.75 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -177.376 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 12.2 tp60 -59.92 -47.27 86.47 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 122.505 0.322 . . . . 0.0 110.736 177.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.59 -46.04 77.25 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.091 0.472 . . . . 0.0 111.412 -176.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 77.9 mt -54.2 -50.66 54.06 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 170.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.46 -48.14 22.14 Favored Glycine 0 CA--C 1.528 0.89 0 C-N-CA 124.966 1.27 . . . . 0.0 111.893 174.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.9 mt -55.52 -56.8 16.02 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 117.71 0.755 . . . . 0.0 110.553 174.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.6 mp -57.98 -43.46 86.56 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 119.018 0.826 . . . . 0.0 111.752 -178.108 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 73.5 mt -55.48 -56.53 11.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 C-N-CA 124.03 0.932 . . . . 0.0 110.356 173.255 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.58 -49.33 65.74 Favored Glycine 0 CA--C 1.523 0.542 0 N-CA-C 110.544 -1.022 . . . . 0.0 110.544 -177.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 8.7 mm -54.03 -48.44 64.39 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 C-N-CA 123.674 0.79 . . . . 0.0 110.148 176.099 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -54.98 -61.4 2.33 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 118.45 0.568 . . . . 0.0 109.525 176.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -53.42 -39.32 64.27 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.583 0.753 . . . . 0.0 111.633 -174.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -50.64 -36.77 37.01 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.842 0.857 . . . . 0.0 111.734 178.161 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -101.12 -53.37 3.04 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.306 0.642 . . . . 0.0 110.028 -178.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 CA--C 1.529 0.144 0 O-C-N 121.322 -0.861 . . . . 0.0 111.907 179.993 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 48.0 p . . . . . 0 N--CA 1.453 -0.314 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -154.79 159.04 40.35 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 122.631 0.372 . . . . 0.0 111.463 169.617 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 81.0 p -103.38 167.12 10.01 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.782 0.833 . . . . 0.0 112.936 -169.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.0 pttm -32.98 -48.69 0.21 Allowed 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 127.158 2.183 . . . . 0.0 113.987 170.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.5 tmmm? -60.1 -52.23 66.25 Favored 'General case' 0 N--CA 1.453 -0.311 0 O-C-N 121.969 -0.457 . . . . 0.0 109.9 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -61.08 -36.35 79.41 Favored 'General case' 0 C--O 1.223 -0.311 0 CA-C-O 119.346 -0.359 . . . . 0.0 110.776 178.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 48.6 mt -67.99 -49.9 58.86 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.575 0.625 . . . . 0.0 111.659 179.498 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp -60.46 -39.71 88.56 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 121.912 -0.493 . . . . 0.0 109.972 176.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -56.88 -63.96 1.03 Allowed 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 169.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.7 mt -39.49 -58.64 1.23 Allowed 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 125.212 1.405 . . . . 0.0 112.266 -178.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 16.0 tt -58.61 -51.37 72.63 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 -177.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -59.26 -42.01 90.15 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 120.995 -1.065 . . . . 0.0 112.718 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.1 mmpt? -77.7 -49.53 14.27 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 125.256 1.423 . . . . 0.0 110.694 -170.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -102.77 -24.05 13.75 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.914 1.286 . . . . 0.0 112.709 -168.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 69.5 mt . . . . . 0 CA--C 1.527 0.064 0 N-CA-C 107.384 -1.339 . . . . 0.0 107.384 169.025 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 . . . . . 0 N--CA 1.462 0.173 0 N-CA-C 113.808 1.04 . . . . 0.0 113.808 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.27 -54.89 0.14 Allowed 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.948 1.699 . . . . 0.0 113.357 177.038 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 74.4 tt0 -67.29 -42.98 82.86 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.482 0.658 . . . . 0.0 111.031 -175.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.456 ' N ' HD12 ' A' ' 53' ' ' ILE . 1.1 mp -62.22 -50.6 79.33 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 N-CA-C 106.565 -1.643 . . . . 0.0 106.565 -178.242 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 77.1 t -54.09 -56.25 10.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 N-CA-C 109.09 -0.708 . . . . 0.0 109.09 176.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.9 mptt -45.23 -52.54 9.38 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 123.235 0.614 . . . . 0.0 112.317 -179.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 15.3 mt -50.07 -42.31 49.68 Favored 'General case' 0 CA--C 1.535 0.378 0 O-C-N 123.194 0.309 . . . . 0.0 111.815 -179.068 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 1.2 mpp? -81.39 -66.15 0.92 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.694 0.798 . . . . 0.0 109.642 179.149 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -40.29 -37.73 0.69 Allowed 'General case' 0 N--CA 1.461 0.093 0 C-N-CA 127.503 2.321 . . . . 0.0 112.789 -178.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -38.45 -53.37 1.55 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.939 0.896 . . . . 0.0 112.124 172.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -60.51 -37.1 80.04 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 110.564 -0.162 . . . . 0.0 110.564 -175.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -73.82 -51.53 16.03 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.624 0.77 . . . . 0.0 109.83 -177.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.534 0.35 0 CA-C-O 120.435 0.159 . . . . 0.0 111.001 -177.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 51.6 mp0 . . . . . 0 N--CA 1.451 -0.383 0 N-CA-C 105.429 -2.063 . . . . 0.0 105.429 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.0 m -79.05 138.03 20.78 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 -169.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -79.82 171.89 14.51 Favored 'General case' 0 C--O 1.231 0.113 0 C-N-CA 122.685 0.394 . . . . 0.0 110.577 176.465 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -43.95 -56.93 3.61 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.623 0.769 . . . . 0.0 112.673 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 34.8 tp60 -63.73 -33.71 76.25 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 120.968 -1.083 . . . . 0.0 110.789 -176.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -66.62 -42.01 87.48 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 118.761 0.709 . . . . 0.0 110.641 176.358 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -54.69 -48.59 72.25 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 121.653 -0.654 . . . . 0.0 109.813 169.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.449 ' CG2' ' CG2' ' B' ' 74' ' ' ILE . 24.4 mm -62.51 -29.75 47.56 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 O-C-N 121.828 -0.545 . . . . 0.0 111.275 175.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 39.1 m -68.23 -43.7 77.35 Favored 'General case' 0 C--O 1.225 -0.205 0 O-C-N 120.922 -1.112 . . . . 0.0 109.496 173.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 58.1 t80 -56.28 -58.06 9.6 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 175.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 71.1 mt -61.3 -44.48 97.15 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 122.101 -0.374 . . . . 0.0 111.79 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.78 -44.03 95.37 Favored Glycine 0 CA--C 1.527 0.811 0 N-CA-C 111.071 -0.812 . . . . 0.0 111.071 -176.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.12 -47.92 75.46 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 117.798 0.799 . . . . 0.0 109.938 176.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 37.6 tp -47.11 -57.31 5.23 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 121.786 0.803 . . . . 0.0 110.226 172.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -53.38 -49.51 67.06 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 114.633 -1.167 . . . . 0.0 110.904 177.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 44.9 ttm -57.68 -51.23 70.37 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.171 0.988 . . . . 0.0 110.689 -179.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 65.4 mt -61.32 -50.71 79.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-O 118.287 -0.863 . . . . 0.0 109.577 -176.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.431 1.7 p90 -72.89 -40.79 65.3 Favored 'General case' 0 C--N 1.347 0.469 0 C-N-CA 118.818 -1.153 . . . . 0.0 113.301 -177.464 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 43.7 m-80 -78.81 74.85 5.33 Favored 'General case' 0 N--CA 1.462 0.135 0 O-C-N 121.077 -1.015 . . . . 0.0 108.634 172.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -39.56 -41.55 1.03 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.525 1.53 . . . . 0.0 113.074 -179.187 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -38.37 -46.41 1.12 Allowed 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.349 1.46 . . . . 0.0 112.885 173.114 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.0 mt . . . . . 0 CA--C 1.534 0.348 0 C-N-CA 124.315 1.046 . . . . 0.0 113.367 -175.715 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.249 0 CA-C-O 120.739 0.304 . . . . 0.0 110.633 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 2.9 m -52.83 159.41 1.81 Allowed Pre-proline 0 CA--C 1.542 0.655 0 C-N-CA 123.56 0.744 . . . . 0.0 110.976 171.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -49.02 -50.08 13.66 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 123.067 2.512 . . . . 0.0 113.099 -177.255 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.3 mt -55.56 -45.07 77.33 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 173.117 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -64.21 -38.57 91.52 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 118.35 0.523 . . . . 0.0 109.868 -176.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 14.2 tp60 -64.43 -46.75 81.87 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.542 0.337 . . . . 0.0 110.838 174.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.39 -47.87 80.24 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.539 0.685 . . . . 0.0 110.989 -178.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 74.6 mt -53.35 -51.95 36.19 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 169.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.66 -43.48 21.99 Favored Glycine 0 CA--C 1.526 0.773 0 C-N-CA 125.717 1.627 . . . . 0.0 112.109 175.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 mt -59.38 -54.15 50.04 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 117.704 0.752 . . . . 0.0 110.598 173.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.7 mp -58.23 -43.66 87.85 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 118.814 0.734 . . . . 0.0 111.341 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 76.3 mt -56.03 -55.93 15.63 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.157 0 C-N-CA 123.825 0.85 . . . . 0.0 109.921 173.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -53.97 -50.61 54.22 Favored Glycine 0 CA--C 1.521 0.445 0 N-CA-C 110.023 -1.231 . . . . 0.0 110.023 -177.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 8.6 mm -53.0 -48.88 51.55 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 C-N-CA 123.508 0.723 . . . . 0.0 110.586 175.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -57.24 -60.99 2.79 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.949 0.404 . . . . 0.0 109.953 177.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -52.07 -40.63 61.48 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 125.418 1.487 . . . . 0.0 111.564 -174.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -46.36 -34.6 4.72 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.538 1.535 . . . . 0.0 111.623 179.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 85.4 m-85 -110.71 -50.15 2.98 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 122.817 0.447 . . . . 0.0 110.786 177.274 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 12.4 p . . . . . 0 C--O 1.227 -0.104 0 C-N-CA 123.427 0.691 . . . . 0.0 111.126 -174.56 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 17.7 p-80 . . . . . 0 CA--C 1.536 0.412 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 32.6 p -132.49 164.41 26.64 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 123.947 0.899 . . . . 0.0 109.739 176.333 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -160.21 167.21 28.12 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.771 0.428 . . . . 0.0 110.936 169.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 46.7 m -113.71 170.09 8.5 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.923 1.289 . . . . 0.0 113.449 -169.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -32.2 -52.23 0.27 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 128.299 2.64 . . . . 0.0 115.265 178.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -59.03 -59.29 5.7 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -178.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -52.48 -39.88 61.69 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 123.521 0.728 . . . . 0.0 111.37 177.052 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 54.3 mt -65.05 -51.31 62.25 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 118.8 0.727 . . . . 0.0 112.079 179.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 8.2 mtmp? -61.77 -45.3 94.48 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 121.662 -0.649 . . . . 0.0 109.908 178.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -49.93 -56.91 8.74 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.45 0.7 . . . . 0.0 110.512 169.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 4.1 mt -45.5 -61.79 1.54 Allowed 'General case' 0 CA--C 1.521 -0.173 0 C-N-CA 124.351 1.06 . . . . 0.0 110.416 177.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 2.8 tp -60.55 -49.25 85.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 -173.376 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 -55.17 -48.55 73.62 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.302 1.041 . . . . 0.0 111.838 -178.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 8.5 mtmp? -76.66 -53.11 8.45 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 120.914 0.388 . . . . 0.0 111.264 -176.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -78.89 -26.47 43.86 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -167.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 49.9 mt . . . . . 0 N--CA 1.456 -0.132 0 N-CA-C 106.438 -1.69 . . . . 0.0 106.438 167.632 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 . . . . . 0 C--O 1.225 -0.235 0 N-CA-C 114.203 1.186 . . . . 0.0 114.203 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.84 -59.69 0.17 Allowed 'General case' 0 CA--C 1.527 0.096 0 C-N-CA 125.882 1.673 . . . . 0.0 113.732 178.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 74.1 tt0 -65.86 -38.44 88.83 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.742 0.306 . . . . 0.0 110.695 -173.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 53' ' ' ILE . . . . . 0.524 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.1 mp -63.5 -53.43 45.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 N-CA-C 106.893 -1.521 . . . . 0.0 106.893 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 78.8 t -56.02 -44.36 78.19 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 C-N-CA 124.226 1.011 . . . . 0.0 110.04 179.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -56.1 -53.91 51.38 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 118.779 0.718 . . . . 0.0 110.759 173.117 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 66.6 mt -53.56 -41.29 66.33 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 119.082 -0.485 . . . . 0.0 111.374 178.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 25.9 mmt -67.57 -61.36 1.93 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.896 0.771 . . . . 0.0 109.646 176.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -42.8 -43.88 4.19 Favored 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 127.441 2.296 . . . . 0.0 111.437 -177.731 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -39.64 -48.66 2.14 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.397 1.079 . . . . 0.0 112.302 176.115 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 10.2 mp -63.02 -48.59 78.11 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 -176.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -62.83 -45.32 93.17 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 122.825 0.45 . . . . 0.0 110.606 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 45.4 ttm-85 -55.73 -51.95 65.59 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 123.6 0.76 . . . . 0.0 109.198 176.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 . . . . . 0 CA--C 1.53 0.203 0 C-N-CA 123.079 0.552 . . . . 0.0 110.586 -176.675 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 . . . . . 0 N--CA 1.453 -0.29 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 5.6 m -78.98 140.93 16.1 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 174.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 18.6 p30 -82.89 172.82 12.41 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 123.556 0.742 . . . . 0.0 110.902 175.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -44.34 -60.18 2.05 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.001 0.92 . . . . 0.0 112.56 176.049 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 50.4 tp60 -62.72 -35.51 79.98 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 119.381 0.991 . . . . 0.0 110.925 -175.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 57.9 mm-40 -60.82 -47.75 84.91 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 119.032 0.833 . . . . 0.0 111.094 173.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -53.25 -49.22 67.32 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 122.004 -0.435 . . . . 0.0 110.145 172.549 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 0.449 ' CG2' ' CG2' ' A' ' 74' ' ' ILE . 29.8 mm -57.83 -39.21 69.94 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 O-C-N 121.735 -0.603 . . . . 0.0 110.66 176.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 57.8 m -63.87 -41.09 97.83 Favored 'General case' 0 C--O 1.227 -0.125 0 O-C-N 121.587 -0.695 . . . . 0.0 110.106 177.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 32.0 t80 -54.32 -53.16 57.64 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 173.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 75.9 mt -62.4 -42.28 99.31 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 178.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.32 -42.39 94.07 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 110.718 -0.953 . . . . 0.0 110.718 -177.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.6 -46.76 88.45 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 123.41 0.684 . . . . 0.0 109.886 174.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 10.2 tp -51.51 -54.59 25.63 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 174.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -53.08 -52.5 58.38 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.899 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 28.8 mtt -50.7 -55.69 15.4 Favored 'General case' 0 CA--C 1.526 0.049 0 C-N-CA 123.825 0.85 . . . . 0.0 111.347 174.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 49.0 mt -63.12 -47.37 92.8 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.327 0 CA-C-O 118.105 -0.95 . . . . 0.0 110.433 -169.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.475 0.0 OUTLIER -83.48 -39.69 20.18 Favored 'General case' 0 C--N 1.347 0.463 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 179.818 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 16.4 m-80 -82.37 65.98 7.75 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 107.294 -1.373 . . . . 0.0 107.294 169.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -43.96 -37.86 3.15 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.543 1.137 . . . . 0.0 112.701 -174.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.27 -48.46 0.23 Allowed 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 127.024 2.13 . . . . 0.0 113.346 169.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 97.3 mt . . . . . 0 CA--C 1.528 0.104 0 N-CA-C 112.573 0.583 . . . . 0.0 112.573 -176.356 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.259 0 CA-C-O 120.506 0.193 . . . . 0.0 111.317 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.4 m -52.67 157.91 2.39 Favored Pre-proline 0 CA--C 1.534 0.353 0 C-N-CA 123.991 0.916 . . . . 0.0 110.266 172.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_exo -40.09 -52.03 2.98 Favored 'Trans proline' 0 N--CA 1.459 -0.511 0 C-N-CA 124.038 3.158 . . . . 0.0 113.82 -179.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 5' ' ' LEU . 5.6 mt -54.05 -60.41 3.36 Favored 'General case' 0 C--O 1.225 -0.207 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 173.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -55.77 -40.11 72.14 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-O 121.004 0.43 . . . . 0.0 110.708 -175.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -64.96 -51.63 60.72 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.356 1.062 . . . . 0.0 110.144 -179.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.05 -46.77 87.4 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.221 1.008 . . . . 0.0 110.901 178.453 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 69.1 mt -51.94 -55.07 10.83 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 170.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.23 -47.88 20.95 Favored Glycine 0 CA--C 1.527 0.834 0 C-N-CA 125.148 1.356 . . . . 0.0 112.033 176.372 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.9 mt -55.0 -53.43 55.85 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.612 0.765 . . . . 0.0 110.986 174.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -59.33 -45.0 92.54 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 121.582 -0.699 . . . . 0.0 111.792 179.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.479 HD11 ' HB1' ' B' ' 81' ' ' ALA . 83.9 mt -55.72 -55.6 16.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 C-N-CA 123.714 0.806 . . . . 0.0 109.819 175.177 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -52.74 -51.97 41.32 Favored Glycine 0 CA--C 1.521 0.447 0 N-CA-C 109.724 -1.35 . . . . 0.0 109.724 -177.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.44 HG21 HD11 ' B' ' 5' ' ' LEU . 3.2 mm -56.71 -47.31 82.7 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 CA-C-O 119.332 -0.366 . . . . 0.0 110.634 179.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.4 ' HB2' ' CE2' ' A' ' 73' ' ' TYR . 73.7 t80 -53.03 -60.44 3.29 Favored 'General case' 0 C--N 1.339 0.14 0 CA-C-N 118.126 0.421 . . . . 0.0 110.055 175.388 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -60.55 -34.69 74.52 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 118.987 -0.53 . . . . 0.0 111.19 -171.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.3 ttpp -52.72 -37.9 59.92 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.134 0.574 . . . . 0.0 111.442 -179.258 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -97.27 -58.48 2.0 Favored 'General case' 0 C--O 1.227 -0.116 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 175.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.8 t . . . . . 0 CA--C 1.533 0.303 0 C-N-CA 124.369 1.068 . . . . 0.0 111.733 -173.727 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 31.6 p . . . . . 0 N--CA 1.446 -0.63 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -158.43 177.55 11.13 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.816 1.247 . . . . 0.0 108.059 174.028 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 8.5 t -139.13 -169.46 2.66 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 119.861 1.209 . . . . 0.0 112.282 -175.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 41.9 pttt -41.44 -54.07 3.2 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 127.279 2.231 . . . . 0.0 113.61 -169.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -53.62 -51.94 61.47 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.064 0.546 . . . . 0.0 110.267 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 14.6 mp0 -64.92 -41.87 95.19 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 -178.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 41.8 mt -62.07 -47.38 84.91 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 118.544 0.611 . . . . 0.0 111.528 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -61.51 -49.94 74.72 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 176.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 78.3 tt0 -48.82 -54.89 13.32 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.168 0.987 . . . . 0.0 110.574 175.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.5 mt -48.41 -75.26 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 126.007 1.723 . . . . 0.0 109.022 174.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 15.6 tt -55.26 -47.05 78.16 Favored 'Isoleucine or valine' 0 C--N 1.341 0.235 0 CA-C-N 118.427 0.558 . . . . 0.0 111.268 -169.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.3 tt0 -52.23 -47.79 65.5 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 123.64 0.776 . . . . 0.0 111.37 -177.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 73.1 mttt -81.01 -62.58 1.62 Allowed 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 121.733 0.778 . . . . 0.0 109.506 -179.059 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -55.87 -36.33 67.47 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 114.842 -1.072 . . . . 0.0 111.882 -169.562 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 85.1 mt . . . . . 0 N--CA 1.452 -0.369 0 C-N-CA 124.842 1.257 . . . . 0.0 107.743 171.155 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 . . . . . 0 CA--C 1.528 0.11 0 N-CA-C 114.412 1.264 . . . . 0.0 114.412 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.84 -60.39 0.16 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.804 1.642 . . . . 0.0 114.1 -174.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -65.29 -42.68 92.89 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 122.958 0.503 . . . . 0.0 111.137 -175.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.545 HD12 ' H ' ' A' ' 53' ' ' ILE . 1.2 mp -60.01 -53.01 54.5 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 N-CA-C 106.876 -1.528 . . . . 0.0 106.876 -178.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 72.1 t -54.13 -55.35 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 CA-C-N 115.523 -0.762 . . . . 0.0 108.976 178.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -47.26 -54.48 10.78 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 118.489 0.586 . . . . 0.0 111.724 178.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 25.8 mt -51.55 -41.11 60.87 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 -177.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -80.79 -65.26 1.03 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.343 0.657 . . . . 0.0 110.37 178.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -37.91 -42.43 0.62 Allowed 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 127.38 2.272 . . . . 0.0 112.139 179.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -38.22 -49.27 1.36 Allowed 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 124.671 1.188 . . . . 0.0 112.546 175.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.8 pp -58.73 -41.68 87.02 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.459 0.572 . . . . 0.0 111.148 -175.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -75.66 -46.28 32.3 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 123.661 0.784 . . . . 0.0 109.967 -178.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 59.7 ttm-85 . . . . . 0 CA--C 1.529 0.159 0 C-N-CA 123.831 0.852 . . . . 0.0 110.291 176.495 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 . . . . . 0 N--CA 1.454 -0.245 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.6 m -79.65 145.63 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 172.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.9 p-10 -88.54 177.88 6.67 Favored 'General case' 0 C--O 1.231 0.086 0 C-N-CA 122.832 0.453 . . . . 0.0 110.825 175.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -42.6 -59.73 1.8 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.684 0.794 . . . . 0.0 112.241 172.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 61.6 tp60 -60.75 -37.0 80.34 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 119.294 0.952 . . . . 0.0 111.683 -175.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -67.97 -37.43 81.52 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.248 -0.908 . . . . 0.0 111.217 176.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.4 ' CE2' ' HB2' ' A' ' 16' ' ' PHE . 0.4 OUTLIER -58.0 -48.43 80.04 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.12 -0.988 . . . . 0.0 109.474 169.344 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 30.6 mm -58.76 -32.8 47.53 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 123.171 0.589 . . . . 0.0 110.497 175.558 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 56.0 m -69.86 -38.96 76.6 Favored 'General case' 0 C--O 1.225 -0.216 0 O-C-N 121.504 -0.747 . . . . 0.0 110.621 174.052 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -59.16 -55.73 31.28 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.56 0.618 . . . . 0.0 109.366 174.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 32.1 mt -56.8 -46.61 81.46 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 120.711 0.291 . . . . 0.0 110.931 175.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -58.18 -44.3 94.93 Favored Glycine 0 CA--C 1.525 0.673 0 C-N-CA 124.346 0.974 . . . . 0.0 111.448 -178.11 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.58 -47.43 69.75 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.45 0.7 . . . . 0.0 109.899 178.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -49.98 -54.3 20.86 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.446 0.641 . . . . 0.0 109.565 173.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -53.15 -55.57 23.07 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 124.702 1.201 . . . . 0.0 110.968 177.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 40.2 ttm -52.33 -52.12 54.96 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 124.775 1.23 . . . . 0.0 110.524 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 56.6 mt -62.81 -51.68 68.95 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-O 118.088 -0.958 . . . . 0.0 109.706 -172.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.427 0.0 OUTLIER -81.51 -32.31 32.42 Favored 'General case' 0 C--N 1.346 0.436 0 N-CA-C 114.667 1.358 . . . . 0.0 114.667 -176.392 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -80.36 76.48 7.17 Favored 'General case' 0 CA--C 1.521 -0.157 0 O-C-N 120.714 -1.242 . . . . 0.0 108.615 175.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -35.07 -49.83 0.48 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.522 1.529 . . . . 0.0 111.689 177.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -38.33 -43.78 0.84 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 126.893 2.077 . . . . 0.0 114.088 177.007 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 55.2 mt . . . . . 0 N--CA 1.456 -0.158 0 CA-C-O 119.432 -0.318 . . . . 0.0 111.339 -178.47 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.241 0 CA-C-O 121.137 0.494 . . . . 0.0 110.581 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 4.5 t -45.71 150.43 0.95 Allowed Pre-proline 0 CA--C 1.535 0.393 0 C-N-CA 124.292 1.037 . . . . 0.0 110.521 169.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo -43.56 -42.73 11.19 Favored 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 123.083 2.522 . . . . 0.0 112.097 168.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.44 HD11 HG21 ' A' ' 15' ' ' ILE . 5.0 mt -66.57 -43.06 86.0 Favored 'General case' 0 C--O 1.223 -0.331 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 174.134 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -57.07 -46.47 82.48 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 119.015 0.825 . . . . 0.0 109.407 177.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 -58.99 -52.73 64.49 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.57 0.748 . . . . 0.0 110.805 175.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.14 -46.76 85.73 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.301 0.64 . . . . 0.0 112.063 -175.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 73.9 mt -54.5 -53.21 32.95 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 N-CA-C 107.886 -1.154 . . . . 0.0 107.886 170.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.25 -46.27 15.99 Favored Glycine 0 CA--C 1.528 0.846 0 C-N-CA 124.64 1.114 . . . . 0.0 112.067 175.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 mt -58.23 -57.37 13.18 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.918 0.887 . . . . 0.0 110.918 174.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.07 -43.74 87.14 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.264 0.938 . . . . 0.0 111.669 -178.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 59.3 mt -56.35 -55.35 19.44 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.156 0 C-N-CA 123.623 0.769 . . . . 0.0 110.0 173.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.89 -49.15 63.28 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 110.566 -1.014 . . . . 0.0 110.566 -177.131 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 11.2 mm -53.06 -49.37 50.28 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 C-N-CA 123.454 0.701 . . . . 0.0 109.871 175.05 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 37.7 t80 -56.8 -52.43 65.07 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 121.805 -0.559 . . . . 0.0 110.768 176.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -58.57 -38.3 77.58 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 124.687 1.195 . . . . 0.0 111.106 -174.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 61.8 tttm -57.76 -25.82 60.99 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.933 1.293 . . . . 0.0 112.497 -179.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 56.2 m-85 -117.1 -62.22 1.61 Allowed 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.372 0.669 . . . . 0.0 109.903 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.332 -0.191 0 C-N-CA 124.164 0.985 . . . . 0.0 110.162 -176.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 12.9 t-80 . . . . . 0 CA--C 1.534 0.336 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -138.54 158.75 43.66 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 125.195 1.398 . . . . 0.0 111.316 -169.052 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.47 176.11 12.0 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 125.388 1.475 . . . . 0.0 108.212 171.397 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 7.3 t -135.59 -166.27 1.82 Allowed 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.731 1.151 . . . . 0.0 113.304 177.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -38.67 -65.12 0.38 Allowed 'General case' 0 N--CA 1.458 -0.064 0 C-N-CA 128.19 2.596 . . . . 0.0 113.175 -169.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 36.3 ttpt -51.96 -50.3 61.49 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 123.465 0.706 . . . . 0.0 110.238 -175.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -61.36 -43.97 97.97 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 123.25 0.62 . . . . 0.0 110.15 -177.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 34.7 mt -62.4 -50.89 69.73 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 118.187 0.449 . . . . 0.0 111.546 177.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -61.93 -42.3 98.94 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 -178.211 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -56.42 -65.33 0.62 Allowed 'General case' 0 C--O 1.22 -0.476 0 CA-C-O 118.515 -0.755 . . . . 0.0 109.13 169.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 5.5 mt -35.04 -62.98 0.35 Allowed 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 125.321 1.449 . . . . 0.0 111.687 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 15.9 tt -60.49 -50.78 79.0 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 C-N-CA 120.297 -0.561 . . . . 0.0 110.306 -175.074 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 16.0 tt0 -62.11 -41.07 97.86 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.317 0.508 . . . . 0.0 112.151 -176.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 6.2 mmpt? -69.85 -54.13 14.92 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.637 1.175 . . . . 0.0 109.473 -177.306 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 -83.43 -35.54 24.92 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.58 -0.736 . . . . 0.0 112.682 -167.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 47.1 mt . . . . . 0 C--N 1.339 0.14 0 CA-C-N 119.36 0.982 . . . . 0.0 108.809 170.834 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 . . . . . 0 CA--C 1.53 0.2 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.35 -58.15 0.15 Allowed 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 126.541 1.936 . . . . 0.0 113.972 -178.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 65.0 tt0 -68.34 -40.41 81.57 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 121.066 0.46 . . . . 0.0 110.878 -172.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 53' ' ' ILE . . . . . 0.64 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.9 mp -62.99 -52.5 58.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 N-CA-C 106.865 -1.531 . . . . 0.0 106.865 179.378 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 72.0 t -54.85 -46.63 75.49 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 C-N-CA 124.362 1.065 . . . . 0.0 109.829 178.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.42 -53.61 54.07 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 119.402 1.001 . . . . 0.0 110.565 175.404 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 39.9 mt -53.22 -41.47 65.38 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 118.972 -0.537 . . . . 0.0 111.494 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 27.8 mmt -70.21 -65.14 0.76 Allowed 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 118.716 0.689 . . . . 0.0 109.643 175.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -43.71 -35.02 1.67 Allowed 'General case' 0 CA--C 1.518 -0.282 0 C-N-CA 128.356 2.662 . . . . 0.0 112.192 -174.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -37.85 -49.97 1.24 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.0 0.92 . . . . 0.0 111.87 173.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.9 pp -61.34 -43.48 98.79 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.366 0.53 . . . . 0.0 111.331 -177.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -69.6 -41.11 76.19 Favored 'General case' 0 C--O 1.226 -0.183 0 C-N-CA 123.941 0.896 . . . . 0.0 110.113 -177.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 14.2 ttm180 -62.73 -48.5 78.96 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 124.76 1.224 . . . . 0.0 110.033 179.55 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 . . . . . 0 C--O 1.226 -0.143 0 CA-C-N 116.713 -0.221 . . . . 0.0 111.248 -175.401 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 16.3 mp0 . . . . . 0 N--CA 1.451 -0.413 0 CA-C-O 120.459 0.171 . . . . 0.0 110.839 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 25.2 m -101.56 151.22 5.65 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 N-CA-C 106.698 -1.593 . . . . 0.0 106.698 167.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 10.2 p30 -94.67 171.86 8.53 Favored 'General case' 0 C--O 1.231 0.129 0 C-N-CA 123.404 0.682 . . . . 0.0 110.624 176.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -35.5 -59.87 0.53 Allowed 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.351 1.461 . . . . 0.0 113.486 177.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -66.53 -31.77 72.71 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 120.429 1.468 . . . . 0.0 111.616 -174.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.34 -36.44 68.81 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 121.271 -0.893 . . . . 0.0 109.822 177.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -56.29 -53.77 53.29 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 168.4 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 19.9 mm -53.74 -42.0 49.96 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.406 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 177.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 70.4 m -63.06 -27.21 69.24 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 119.018 0.827 . . . . 0.0 111.831 177.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 10.7 t80 -58.35 -52.84 63.92 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.459 1.027 . . . . 0.0 108.321 170.131 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 48.8 mt -64.61 -41.31 96.29 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.861 0.865 . . . . 0.0 111.668 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -70.78 -42.27 61.77 Favored Glycine 0 CA--C 1.526 0.749 0 C-N-CA 124.408 1.004 . . . . 0.0 110.658 -175.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.21 -43.91 76.96 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 121.924 -0.75 . . . . 0.0 110.079 175.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 12.1 tp -49.61 -56.8 8.71 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 121.281 0.563 . . . . 0.0 109.774 171.159 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . 0.479 ' HB1' HD11 ' A' ' 13' ' ' ILE . . . -50.15 -53.67 25.99 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 124.391 1.076 . . . . 0.0 110.32 178.188 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 53.7 ttm -54.45 -50.07 68.55 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.937 0.895 . . . . 0.0 111.129 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 98.1 mt -63.95 -55.01 24.63 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 CA-C-O 118.48 -0.772 . . . . 0.0 110.578 -176.154 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.45 0.1 OUTLIER -76.69 -35.2 58.04 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.419 1.009 . . . . 0.0 113.284 -175.029 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 26.0 m-80 -82.55 72.79 9.61 Favored 'General case' 0 N--CA 1.465 0.284 0 O-C-N 120.63 -1.294 . . . . 0.0 107.97 169.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -46.89 -31.48 3.14 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.968 0.907 . . . . 0.0 113.051 -176.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -42.15 -41.88 2.81 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.879 1.272 . . . . 0.0 113.106 172.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 84.2 mt . . . . . 0 CA--C 1.531 0.226 0 C-N-CA 123.161 0.584 . . . . 0.0 112.424 -179.3 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.228 0 CA-C-O 120.868 0.366 . . . . 0.0 110.523 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.59 165.84 2.07 Favored Pre-proline 0 CA--C 1.538 0.493 0 C-N-CA 124.282 1.033 . . . . 0.0 111.143 176.922 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_exo -46.26 -47.98 13.99 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 123.367 2.711 . . . . 0.0 113.054 178.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.418 HD23 ' HA ' ' A' ' 5' ' ' LEU . 6.1 mt -56.95 -49.84 74.46 Favored 'General case' 0 C--N 1.34 0.168 0 CA-C-O 119.472 -0.299 . . . . 0.0 111.428 175.196 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -58.97 -45.04 91.52 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-N 118.248 0.476 . . . . 0.0 109.857 -178.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -59.43 -49.99 75.67 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 122.9 0.48 . . . . 0.0 110.239 178.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.69 -45.87 84.8 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.416 0.687 . . . . 0.0 111.666 -177.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 71.5 mt -54.72 -50.94 56.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 171.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.74 -49.44 22.09 Favored Glycine 0 CA--C 1.526 0.771 0 C-N-CA 125.012 1.291 . . . . 0.0 111.527 174.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.3 mt -54.79 -56.67 16.89 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 117.576 0.688 . . . . 0.0 110.889 173.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -57.28 -42.59 81.93 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 119.203 0.91 . . . . 0.0 111.72 -178.366 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 95.6 mt -59.81 -54.11 39.11 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 123.518 0.727 . . . . 0.0 110.908 174.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.4 -50.59 61.63 Favored Glycine 0 CA--C 1.522 0.511 0 N-CA-C 109.883 -1.287 . . . . 0.0 109.883 -177.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 9.9 mm -50.87 -51.76 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 C-N-CA 123.92 0.888 . . . . 0.0 109.968 173.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -52.24 -61.57 2.19 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 178.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 6.0 m-70 -65.33 -23.87 67.11 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 113.958 1.096 . . . . 0.0 113.958 -172.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 62.4 tttm -50.24 -31.94 15.35 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 118.766 0.712 . . . . 0.0 111.147 169.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -113.0 -33.54 6.01 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.482 0.713 . . . . 0.0 112.683 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 77.4 p . . . . . 0 N--CA 1.464 0.25 0 CA-C-N 119.891 1.223 . . . . 0.0 113.204 -178.803 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 46.0 p . . . . . 0 N--CA 1.456 -0.173 0 CA-C-O 120.849 0.357 . . . . 0.0 111.452 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -161.16 -177.19 5.9 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.377 1.471 . . . . 0.0 107.616 168.57 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.4 p -139.25 176.84 8.37 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 119.59 1.086 . . . . 0.0 112.805 -173.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 19.8 pttt -30.84 -53.78 0.19 Allowed 'General case' 0 N--CA 1.457 -0.099 0 C-N-CA 127.646 2.378 . . . . 0.0 114.874 179.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 24.8 ttpp -58.07 -49.12 78.03 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 118.888 0.767 . . . . 0.0 110.743 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.4 mp0 -64.07 -36.02 82.63 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 122.685 0.394 . . . . 0.0 110.619 178.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 45.2 mt -68.07 -47.6 67.85 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.617 0.644 . . . . 0.0 111.204 179.117 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -56.44 -47.38 79.22 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 173.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -53.81 -58.08 8.54 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-O 119.167 -0.445 . . . . 0.0 110.975 172.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.0 mt -45.52 -61.18 1.79 Allowed 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 124.291 1.036 . . . . 0.0 110.406 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 14.7 tt -61.06 -50.27 81.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 C-N-CA 120.507 -0.477 . . . . 0.0 109.858 -175.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -61.85 -53.18 59.39 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 121.493 -0.754 . . . . 0.0 112.305 -175.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -67.02 -59.03 3.82 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.988 0.915 . . . . 0.0 109.39 -178.315 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -79.78 -46.67 16.56 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 119.262 -0.399 . . . . 0.0 111.742 -168.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 20.1 mt . . . . . 0 C--O 1.232 0.145 0 CA-C-N 119.001 0.819 . . . . 0.0 109.41 174.166 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 . . . . . 0 C--O 1.225 -0.235 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -30.33 -56.47 0.19 Allowed 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 125.793 1.637 . . . . 0.0 113.382 176.346 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.9 tm-20 -64.89 -41.52 95.55 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.64 0.734 . . . . 0.0 110.384 -173.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.544 HD12 ' H ' ' A' ' 53' ' ' ILE . 1.1 mp -66.28 -52.74 44.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 N-CA-C 107.053 -1.462 . . . . 0.0 107.053 -177.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 78.6 t -52.89 -41.06 38.72 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 C-N-CA 124.64 1.176 . . . . 0.0 109.777 175.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.7 mptp? -60.53 -51.88 67.54 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 118.988 0.813 . . . . 0.0 110.851 174.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 85.6 mt -52.08 -43.0 63.65 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 119.316 -0.373 . . . . 0.0 110.872 177.036 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 24.7 mmt -68.75 -62.42 1.39 Allowed 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 118.475 0.579 . . . . 0.0 109.94 178.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -45.26 -40.61 7.71 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 127.093 2.157 . . . . 0.0 111.498 -177.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -40.94 -47.31 2.98 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.714 0.806 . . . . 0.0 112.462 175.029 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.1 mp -63.39 -53.86 45.87 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 -178.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -60.95 -34.11 74.23 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 123.625 0.77 . . . . 0.0 111.279 -178.06 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.9 ttm180 . . . . . 0 N--CA 1.449 -0.485 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 173.919 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 . . . . . 0 N--CA 1.454 -0.268 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 11.3 m -103.07 144.31 14.01 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 170.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -86.29 168.4 13.93 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 122.835 0.454 . . . . 0.0 111.158 174.25 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -34.4 -61.31 0.39 Allowed 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 124.547 1.139 . . . . 0.0 112.718 172.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 48.5 tp60 -63.22 -31.66 72.86 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 119.791 1.178 . . . . 0.0 112.072 -174.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -69.68 -42.43 74.14 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 121.305 -0.872 . . . . 0.0 110.022 176.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -54.92 -51.38 66.26 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 170.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 26.9 mm -56.25 -40.26 64.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 C-N-CA 123.158 0.583 . . . . 0.0 110.117 176.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 86.2 m -64.6 -39.01 92.96 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 118.926 0.784 . . . . 0.0 110.961 176.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 44.9 t80 -54.95 -53.54 54.29 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 172.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 58.7 mt -59.14 -42.18 90.03 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.962 -0.461 . . . . 0.0 111.83 176.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -62.41 -45.86 95.05 Favored Glycine 0 CA--C 1.525 0.709 0 C-N-CA 124.177 0.894 . . . . 0.0 110.959 -178.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.89 -44.68 84.6 Favored 'General case' 0 N--CA 1.45 -0.458 0 O-C-N 122.182 -0.599 . . . . 0.0 110.061 177.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 13.1 tp -51.18 -57.24 9.28 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.325 0.583 . . . . 0.0 109.899 173.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -48.75 -56.17 9.38 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 114.812 -1.085 . . . . 0.0 109.942 177.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 46.7 ttm -52.33 -54.44 31.55 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 123.916 0.886 . . . . 0.0 111.071 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 42.1 mt -63.49 -45.75 96.98 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 CA-C-O 118.302 -0.856 . . . . 0.0 110.856 -171.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.446 0.1 OUTLIER -83.05 -30.93 27.66 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 -179.844 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 24.3 m-80 -79.8 71.95 6.49 Favored 'General case' 0 C--O 1.236 0.355 0 O-C-N 120.926 -1.109 . . . . 0.0 108.433 170.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -65.0 74.18 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.572 1.549 . . . . 0.0 109.431 175.206 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -171.89 -47.38 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 128.684 2.794 . . . . 0.0 106.851 -169.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 55.7 mt . . . . . 0 C--N 1.343 0.306 0 N-CA-C 108.412 -0.958 . . . . 0.0 108.412 168.692 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.202 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -49.42 157.31 0.94 Allowed Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 125.459 1.504 . . . . 0.0 110.35 173.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -50.67 -48.42 20.65 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 122.911 2.407 . . . . 0.0 112.213 -174.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.7 mt -55.26 -52.82 62.17 Favored 'General case' 0 C--O 1.225 -0.231 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 172.146 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -58.68 -39.67 81.36 Favored 'General case' 0 C--O 1.225 -0.186 0 CA-C-N 118.243 0.474 . . . . 0.0 110.274 -175.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -64.33 -50.99 65.62 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.503 1.121 . . . . 0.0 110.483 177.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.53 -45.44 94.15 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 121.443 0.639 . . . . 0.0 111.128 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 67.1 mt -53.19 -53.97 20.11 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 169.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.6 -46.96 18.08 Favored Glycine 0 CA--C 1.526 0.775 0 C-N-CA 125.368 1.461 . . . . 0.0 111.986 176.249 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.7 mt -55.45 -56.07 24.4 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 117.635 0.717 . . . . 0.0 110.742 173.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.4 mp -57.59 -42.94 84.21 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 118.973 0.806 . . . . 0.0 111.6 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 77.8 mt -56.97 -55.55 19.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 C-N-CA 123.336 0.654 . . . . 0.0 110.173 174.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.24 -49.68 62.69 Favored Glycine 0 CA--C 1.522 0.527 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 -177.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.5 mm -52.36 -48.71 44.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 C-N-CA 123.242 0.617 . . . . 0.0 110.137 174.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -56.51 -58.2 9.05 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 118.491 0.587 . . . . 0.0 110.47 176.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -54.61 -36.96 65.03 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 125.002 1.321 . . . . 0.0 111.208 -174.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -49.7 -34.43 18.7 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.062 0.945 . . . . 0.0 111.957 177.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 -106.62 -47.67 3.71 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.325 0.65 . . . . 0.0 110.837 178.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 22.7 t . . . . . 0 CA--C 1.534 0.329 0 C-N-CA 123.839 0.856 . . . . 0.0 112.422 -177.866 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 45.6 t-80 . . . . . 0 C--O 1.236 0.349 0 CA-C-O 119.683 -0.199 . . . . 0.0 111.429 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 41.3 p -135.04 163.05 30.75 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.899 1.28 . . . . 0.0 110.459 -175.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -159.87 164.95 33.14 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.527 0.731 . . . . 0.0 110.988 169.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 93.6 p -97.97 168.0 10.56 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.462 1.105 . . . . 0.0 113.641 -169.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 13.6 pttm -40.04 -53.19 2.43 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 126.781 2.032 . . . . 0.0 112.617 171.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -54.65 -45.45 73.82 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.39 0.676 . . . . 0.0 109.968 178.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -71.36 -35.79 71.24 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 123.485 0.714 . . . . 0.0 111.073 -176.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 13.3 mt -62.91 -49.35 75.13 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.224 0.92 . . . . 0.0 110.896 170.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -58.03 -46.31 85.52 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 178.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -54.08 -57.17 12.09 Favored 'General case' 0 C--O 1.222 -0.344 0 CA-C-O 119.001 -0.524 . . . . 0.0 110.663 171.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 9.3 mt -45.44 -60.73 2.0 Favored 'General case' 0 N--CA 1.457 -0.09 0 C-N-CA 123.625 0.77 . . . . 0.0 110.48 -178.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 19.8 tt -60.1 -52.98 54.87 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 120.287 -0.565 . . . . 0.0 110.118 -177.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -59.47 -49.88 76.07 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.739 -0.601 . . . . 0.0 112.535 -174.528 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.11 -53.79 10.14 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.696 0.798 . . . . 0.0 109.815 -176.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 51.8 mm-40 -81.68 -26.62 34.55 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 -167.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 23.9 mt . . . . . 0 CA--C 1.523 -0.083 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 169.243 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 . . . . . 0 CA--C 1.53 0.191 0 N-CA-C 114.162 1.171 . . . . 0.0 114.162 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -35.7 -56.1 0.69 Allowed 'General case' 0 C--O 1.226 -0.14 0 C-N-CA 125.356 1.462 . . . . 0.0 113.148 -175.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -61.69 -41.83 98.11 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.444 0.697 . . . . 0.0 111.18 -176.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 53' ' ' ILE . . . . . 0.505 ' H ' ' CD1' ' B' ' 53' ' ' ILE . 1.1 mp -63.75 -54.08 36.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 106.852 -1.536 . . . . 0.0 106.852 -178.289 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 82.5 t -56.84 -41.13 75.22 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-N 115.265 -0.88 . . . . 0.0 109.729 179.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.44 -51.81 68.3 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 118.907 0.776 . . . . 0.0 110.073 177.507 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 44.9 mt -53.87 -41.11 67.16 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 119.361 -0.352 . . . . 0.0 111.404 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.05 -61.68 1.68 Allowed 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 118.642 0.656 . . . . 0.0 109.753 175.324 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -44.37 -36.4 2.82 Favored 'General case' 0 C--O 1.225 -0.205 0 C-N-CA 126.644 1.978 . . . . 0.0 111.949 -177.206 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -37.38 -46.88 0.81 Allowed 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 125.661 1.584 . . . . 0.0 112.717 178.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -59.27 -49.71 76.8 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 120.665 0.269 . . . . 0.0 110.394 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -64.42 -42.96 95.76 Favored 'General case' 0 C--O 1.225 -0.216 0 C-N-CA 124.089 0.956 . . . . 0.0 110.1 179.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.69 -45.33 70.33 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.697 1.599 . . . . 0.0 109.4 176.64 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 . . . . . 0 C--O 1.227 -0.091 0 C-N-CA 122.94 0.496 . . . . 0.0 112.136 178.563 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 . . . . . 0 N--CA 1.454 -0.257 0 N-CA-C 110.127 -0.323 . . . . 0.0 110.127 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 14.5 m -86.57 150.78 3.74 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 171.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 5.2 p30 -91.35 172.78 8.29 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 123.293 0.637 . . . . 0.0 111.86 176.327 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -41.42 -62.13 0.92 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.258 1.023 . . . . 0.0 113.591 177.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 10.0 tp-100 -65.4 -31.35 72.41 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-N 120.094 1.316 . . . . 0.0 110.808 -177.085 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -64.14 -41.3 97.24 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.175 0.898 . . . . 0.0 110.569 175.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -57.78 -49.76 75.52 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 121.462 -0.774 . . . . 0.0 110.023 169.658 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 21.5 mm -60.07 -26.7 36.96 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 O-C-N 121.787 -0.571 . . . . 0.0 110.782 176.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 52.8 m -75.05 -37.5 61.67 Favored 'General case' 0 C--O 1.225 -0.225 0 O-C-N 120.95 -1.094 . . . . 0.0 110.345 173.072 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 29.1 t80 -55.29 -55.06 35.79 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 118.914 0.779 . . . . 0.0 109.235 170.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 43.9 mt -61.22 -47.3 86.76 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 122.085 -0.385 . . . . 0.0 111.694 177.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -62.1 -41.89 99.71 Favored Glycine 0 CA--C 1.526 0.735 0 N-CA-C 110.946 -0.862 . . . . 0.0 110.946 -175.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.18 -46.5 73.74 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 123.498 0.719 . . . . 0.0 110.268 175.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 18.1 tp -49.97 -53.55 25.73 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 174.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -53.48 -56.83 13.68 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 124.065 0.946 . . . . 0.0 110.394 175.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 40.3 ttm -47.94 -46.62 32.36 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.79 0.836 . . . . 0.0 111.052 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 30.8 mt -72.89 -51.92 24.85 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 CA-C-O 117.908 -1.044 . . . . 0.0 111.379 -176.149 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.416 0.0 OUTLIER -85.11 -36.46 21.13 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 120.31 1.414 . . . . 0.0 114.711 -175.198 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 32.8 m120 -81.87 62.44 5.66 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 107.259 -1.385 . . . . 0.0 107.259 171.036 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 67.2 mt-10 -44.97 -36.49 3.42 Favored 'General case' 0 C--N 1.339 0.111 0 C-N-CA 126.104 1.762 . . . . 0.0 113.618 -169.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -47.77 -31.93 5.41 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.384 1.074 . . . . 0.0 113.015 178.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 31.6 mt . . . . . 0 C--N 1.34 0.177 0 C-N-CA 122.761 0.424 . . . . 0.0 111.949 174.272 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.315 0 CA-C-O 120.666 0.269 . . . . 0.0 111.178 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.4 m -49.25 158.59 0.72 Allowed Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 124.202 1.001 . . . . 0.0 111.433 170.025 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -47.54 -48.28 15.89 Favored 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 123.354 2.703 . . . . 0.0 113.402 -177.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.0 mt -57.42 -49.24 76.87 Favored 'General case' 0 C--O 1.226 -0.183 0 C-N-CA 120.618 -0.433 . . . . 0.0 112.094 173.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -60.97 -41.57 96.63 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 -175.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 19.8 tt0 -59.77 -51.63 68.93 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.801 0.84 . . . . 0.0 110.677 175.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.35 -45.67 92.15 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.506 0.669 . . . . 0.0 111.271 -177.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 66.1 mt -53.28 -51.75 37.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 169.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.17 -48.2 20.35 Favored Glycine 0 CA--C 1.528 0.86 0 C-N-CA 125.183 1.373 . . . . 0.0 111.835 174.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.3 mt -55.12 -55.25 33.18 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 117.83 0.815 . . . . 0.0 110.795 174.067 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.0 mp -58.2 -41.71 84.6 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.55 0.614 . . . . 0.0 111.715 -179.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 97.1 mt -60.58 -51.33 74.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 C-N-CA 123.494 0.718 . . . . 0.0 110.733 174.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.99 -54.03 36.37 Favored Glycine 0 CA--C 1.521 0.462 0 N-CA-C 109.198 -1.561 . . . . 0.0 109.198 -179.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 7.2 mm -51.51 -50.77 28.3 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 C-N-CA 124.102 0.961 . . . . 0.0 110.375 175.145 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -50.63 -60.51 2.96 Favored 'General case' 0 C--N 1.339 0.121 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 177.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -59.33 -39.39 82.97 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 121.041 -0.263 . . . . 0.0 111.088 -175.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.7 ttpp -53.64 -24.77 15.23 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.096 0.958 . . . . 0.0 111.85 178.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -133.9 42.2 2.95 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 118.461 0.573 . . . . 0.0 110.774 169.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 63.6 p . . . . . 0 N--CA 1.457 -0.114 0 CA-C-O 122.254 1.026 . . . . 0.0 108.487 174.244 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 6.0 p . . . . . 0 CA--C 1.529 0.164 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.2 pp -160.25 -176.31 5.56 Favored 'General case' 0 C--N 1.337 0.024 0 C-N-CA 123.873 0.869 . . . . 0.0 109.533 176.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 87.4 p -152.7 -175.52 5.34 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 119.073 0.851 . . . . 0.0 111.955 -178.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -19.7 -69.56 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 129.381 3.072 . . . . 0.0 113.51 175.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -51.53 -50.63 59.64 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 124.874 1.269 . . . . 0.0 110.568 -177.394 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 14.1 mp0 -64.65 -42.77 95.21 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 119.157 -0.449 . . . . 0.0 109.87 -177.485 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 71.9 mt -60.99 -50.1 74.76 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.881 0.764 . . . . 0.0 111.21 177.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -59.56 -44.96 93.12 Favored 'General case' 0 CA--C 1.534 0.36 0 O-C-N 121.937 -0.477 . . . . 0.0 110.298 179.117 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 72.0 mt-10 -56.42 -52.36 64.93 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 122.57 0.348 . . . . 0.0 111.197 173.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 16.3 mt -49.51 -54.82 15.83 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.726 0.81 . . . . 0.0 109.471 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 40.7 mm -54.45 -65.87 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 175.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 -57.0 -49.24 76.39 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -169.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.7 -53.76 8.03 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.2 0.6 . . . . 0.0 110.426 -177.291 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -85.22 -16.59 39.73 Favored 'General case' 0 C--N 1.339 0.14 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -168.143 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 94.1 mt . . . . . 0 N--CA 1.458 -0.073 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 168.619 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 . . . . . 0 CA--C 1.532 0.259 0 N-CA-C 113.578 0.955 . . . . 0.0 113.578 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.88 -60.85 0.16 Allowed 'General case' 0 N--CA 1.46 0.038 0 C-N-CA 126.22 1.808 . . . . 0.0 113.3 -177.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -67.64 -38.71 84.25 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.836 -171.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.592 HD12 ' H ' ' A' ' 53' ' ' ILE . 1.6 mp -61.89 -53.38 48.86 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 N-CA-C 106.164 -1.791 . . . . 0.0 106.164 179.131 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 85.0 t -57.83 -44.46 86.26 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 C-N-CA 124.073 0.949 . . . . 0.0 110.552 -177.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.67 -50.61 73.23 Favored 'General case' 0 CA--C 1.528 0.116 0 CA-C-N 119.262 0.937 . . . . 0.0 111.202 173.263 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 63.2 mt -56.43 -38.22 71.29 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 119.115 -0.469 . . . . 0.0 111.446 178.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 23.3 mmt -69.38 -61.76 1.66 Allowed 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.117 0.871 . . . . 0.0 109.683 175.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -45.88 -40.47 10.04 Favored 'General case' 0 CA--C 1.52 -0.196 0 C-N-CA 126.96 2.104 . . . . 0.0 111.467 -175.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -38.29 -49.97 1.43 Allowed 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.964 1.305 . . . . 0.0 111.546 174.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 77.0 mt -56.69 -50.96 70.59 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 122.495 0.318 . . . . 0.0 110.186 -175.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -69.41 -44.9 70.46 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 123.268 0.627 . . . . 0.0 110.911 -179.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 16.9 ttm180 . . . . . 0 N--CA 1.454 -0.256 0 C-N-CA 124.128 0.971 . . . . 0.0 110.16 -179.065 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 . . . . . 0 N--CA 1.454 -0.247 0 CA-C-O 120.794 0.33 . . . . 0.0 110.987 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.7 m -117.57 160.24 17.24 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 C-N-CA 126.063 1.745 . . . . 0.0 107.955 168.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -105.98 -175.02 2.68 Favored 'General case' 0 CA--C 1.528 0.121 0 C-N-CA 125.102 1.361 . . . . 0.0 111.741 178.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -47.86 -66.14 0.45 Allowed 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 124.328 1.051 . . . . 0.0 112.001 176.069 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.1 tp60 -60.76 -35.56 76.73 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 119.565 1.075 . . . . 0.0 111.453 -173.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -61.61 -47.18 86.61 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.548 -0.72 . . . . 0.0 110.983 175.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -54.74 -50.6 67.99 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.993 -0.442 . . . . 0.0 109.954 172.549 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.405 ' CG2' ' CG2' ' B' ' 74' ' ' ILE . 25.3 mm -57.16 -37.45 55.89 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 C-N-CA 122.97 0.508 . . . . 0.0 110.331 177.533 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 86.6 m -68.09 -39.3 82.91 Favored 'General case' 0 N--CA 1.456 -0.143 0 O-C-N 121.513 -0.742 . . . . 0.0 110.315 177.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 38.0 t80 -56.57 -54.99 39.51 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 173.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 49.2 mt -59.92 -40.0 87.39 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 120.726 0.298 . . . . 0.0 111.476 176.067 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -60.08 -49.64 76.32 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 -179.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.9 -44.96 91.4 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 123.178 0.591 . . . . 0.0 110.25 178.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 11.0 tp -50.52 -57.91 7.0 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.636 0.731 . . . . 0.0 109.734 174.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.45 -53.58 43.66 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 125.037 1.335 . . . . 0.0 110.303 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 39.4 ttm -52.06 -50.06 62.25 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 125.542 1.537 . . . . 0.0 111.026 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 93.3 mt -69.0 -54.9 17.63 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 CA-C-O 118.698 -0.668 . . . . 0.0 110.294 -174.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.451 0.1 OUTLIER -76.14 -35.46 59.21 Favored 'General case' 0 C--N 1.344 0.351 0 C-N-CA 119.051 -1.06 . . . . 0.0 113.398 -173.599 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.4 m-80 -85.13 63.29 8.02 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 106.593 -1.632 . . . . 0.0 106.593 168.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -43.92 -36.77 2.55 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.541 1.136 . . . . 0.0 112.505 -175.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.38 -47.46 0.21 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 127.015 2.126 . . . . 0.0 113.165 169.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 20.3 mt . . . . . 0 C--O 1.225 -0.206 0 C-N-CA 123.974 0.91 . . . . 0.0 111.322 178.58 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.294 0 CA-C-O 121.412 0.625 . . . . 0.0 109.488 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -50.41 159.66 0.83 Allowed Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 124.999 1.319 . . . . 0.0 110.841 170.391 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -52.22 -49.35 17.68 Favored 'Trans proline' 0 N--CA 1.459 -0.538 0 C-N-CA 122.599 2.199 . . . . 0.0 112.1 -178.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.7 mt -58.09 -45.68 86.76 Favored 'General case' 0 C--O 1.226 -0.182 0 C-N-CA 120.624 -0.431 . . . . 0.0 111.03 174.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -58.07 -47.36 83.39 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 118.164 0.438 . . . . 0.0 109.835 -177.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 tp60 -60.61 -47.81 84.56 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 122.913 0.485 . . . . 0.0 110.896 177.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.66 -45.74 81.8 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.209 0.528 . . . . 0.0 111.46 -176.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 74.2 mt -54.14 -51.51 46.31 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 170.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.16 -47.46 20.85 Favored Glycine 0 CA--C 1.528 0.869 0 C-N-CA 124.797 1.189 . . . . 0.0 111.889 174.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 mt -56.26 -57.31 12.79 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 117.582 0.691 . . . . 0.0 110.635 174.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.6 mp -57.9 -41.18 82.08 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.047 0.84 . . . . 0.0 111.805 -177.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 74.0 mt -58.22 -56.41 16.27 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 C-N-CA 124.02 0.928 . . . . 0.0 110.741 172.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.64 -50.73 59.17 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 109.942 -1.263 . . . . 0.0 109.942 -176.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.8 mm -51.15 -50.58 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 C-N-CA 124.076 0.95 . . . . 0.0 110.107 173.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -54.05 -57.71 10.03 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 118.107 0.412 . . . . 0.0 110.222 179.088 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 41.9 m-70 -63.43 -29.23 70.55 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -176.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 64.5 tttp -50.45 -33.21 20.21 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 119.061 0.846 . . . . 0.0 111.841 176.096 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -108.62 -44.37 4.07 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.395 0.678 . . . . 0.0 111.083 177.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.2 m . . . . . 0 CA--C 1.53 0.208 0 C-N-CA 123.927 0.891 . . . . 0.0 112.751 -174.429 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 . . . . . 0 CA--C 1.535 0.369 0 CA-C-O 119.236 -0.411 . . . . 0.0 111.829 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 20.2 p -137.93 164.69 28.39 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.442 1.097 . . . . 0.0 111.304 -172.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.5 175.67 12.48 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.801 1.24 . . . . 0.0 109.184 169.507 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.2 t -131.39 -163.17 1.29 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.499 1.12 . . . . 0.0 112.55 -176.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 6.4 mtpm? -39.71 -67.51 0.22 Allowed 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 128.515 2.726 . . . . 0.0 113.461 -169.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -60.94 -46.85 89.03 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 -169.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -54.35 -44.67 72.35 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.48 0.712 . . . . 0.0 110.747 177.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 30.5 mt -65.06 -47.06 78.65 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 118.065 0.393 . . . . 0.0 111.599 178.543 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 58.5 mttp -57.08 -46.48 82.5 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.647 175.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -57.66 -49.36 76.74 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 122.955 0.502 . . . . 0.0 110.397 175.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 10.4 mt -48.16 -53.47 16.68 Favored 'General case' 0 CA--C 1.527 0.09 0 CA-C-N 119.15 0.886 . . . . 0.0 110.25 178.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 39.8 mt -57.84 -62.09 1.08 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.297 175.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -50.04 -46.87 53.44 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.484 0.714 . . . . 0.0 112.534 -172.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 9.1 mmpt? -81.43 -52.33 7.38 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 125.342 1.457 . . . . 0.0 110.451 -172.198 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -95.75 -16.83 21.68 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 -168.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 54.3 mt . . . . . 0 C--N 1.335 -0.033 0 C-N-CA 125.309 1.444 . . . . 0.0 108.154 173.712 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 18.0 p-10 . . . . . 0 N--CA 1.463 0.221 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.42 -61.33 0.14 Allowed 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 126.895 2.078 . . . . 0.0 113.831 -177.135 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -67.18 -38.71 85.86 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 120.804 0.335 . . . . 0.0 111.282 -172.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 53' ' ' ILE . . . . . 0.677 HD12 ' H ' ' B' ' 53' ' ' ILE . 2.1 mp -63.18 -53.89 40.31 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 N-CA-C 106.861 -1.533 . . . . 0.0 106.861 179.057 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 79.6 t -55.31 -45.35 77.79 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 C-N-CA 124.309 1.044 . . . . 0.0 110.134 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -58.17 -52.45 65.52 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 118.97 0.805 . . . . 0.0 110.203 176.364 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 62.9 mt -54.79 -39.5 68.51 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 119.43 -0.319 . . . . 0.0 111.418 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.83 -67.35 0.48 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 118.484 0.583 . . . . 0.0 109.524 173.727 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -39.62 -41.2 1.01 Allowed 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 127.364 2.266 . . . . 0.0 112.092 -176.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -37.88 -49.89 1.24 Allowed 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.162 1.385 . . . . 0.0 112.158 176.039 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -65.75 -33.7 76.47 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 111.699 0.259 . . . . 0.0 111.699 -174.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -76.8 -53.1 8.37 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 177.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 14.3 ttm180 -48.0 -41.57 25.7 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.311 1.044 . . . . 0.0 110.686 177.276 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 . . . . . 0 N--CA 1.454 -0.236 0 C-N-CA 123.911 0.884 . . . . 0.0 109.916 -178.298 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 64.8 mm-40 . . . . . 0 N--CA 1.452 -0.356 0 N-CA-C 106.042 -1.836 . . . . 0.0 106.042 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 12.3 m -79.25 142.28 14.22 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 176.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -82.41 170.31 15.44 Favored 'General case' 0 N--CA 1.461 0.108 0 C-N-CA 122.917 0.487 . . . . 0.0 111.578 177.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -35.37 -63.02 0.37 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.051 1.34 . . . . 0.0 112.82 173.177 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 10.1 tp-100 -64.53 -32.37 73.98 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 120.35 1.432 . . . . 0.0 111.817 -175.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -66.29 -39.38 89.32 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 120.966 -1.084 . . . . 0.0 110.274 176.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.03 -48.59 79.61 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 121.713 -0.617 . . . . 0.0 109.622 169.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 0.405 ' CG2' ' CG2' ' A' ' 74' ' ' ILE . 20.0 mm -62.18 -23.89 33.16 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 O-C-N 121.612 -0.68 . . . . 0.0 110.891 175.638 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 39.7 m -77.88 -33.72 51.89 Favored 'General case' 0 C--O 1.224 -0.273 0 O-C-N 120.762 -1.211 . . . . 0.0 110.426 171.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -60.16 -55.77 29.72 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.298 -0.876 . . . . 0.0 108.977 170.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 45.4 mt -62.8 -41.62 99.36 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-O 121.035 0.445 . . . . 0.0 111.773 177.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.9 -43.27 96.27 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.598 -1.001 . . . . 0.0 110.598 -178.231 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.55 -46.29 86.64 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.349 0.66 . . . . 0.0 110.209 174.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 6.8 tp -50.41 -58.14 6.39 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.403 0.621 . . . . 0.0 109.83 174.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.5 -52.81 35.1 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.86 1.264 . . . . 0.0 110.21 178.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 57.1 ttm -57.14 -47.43 81.17 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 124.19 0.996 . . . . 0.0 111.139 -178.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 97.1 mt -65.42 -58.63 6.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 -176.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.448 1.1 p90 -67.09 -40.58 86.99 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 118.218 -1.393 . . . . 0.0 112.501 -174.489 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 28.3 m-80 -81.71 66.98 7.51 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 169.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -44.0 -35.44 2.07 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.842 1.257 . . . . 0.0 113.815 -171.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -32.84 -53.3 0.34 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.537 1.535 . . . . 0.0 112.246 168.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 69.1 mt . . . . . 0 CA--C 1.534 0.351 0 N-CA-C 113.787 1.032 . . . . 0.0 113.787 -171.648 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.292 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 40.0 p -73.68 170.58 13.68 Favored Pre-proline 0 N--CA 1.451 -0.38 0 C-N-CA 123.206 0.602 . . . . 0.0 110.059 175.299 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -50.58 -43.93 42.77 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.299 1.999 . . . . 0.0 110.658 168.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.448 HD23 ' HA ' ' A' ' 5' ' ' LEU . 4.8 mt -53.38 -61.06 2.54 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-O 119.234 -0.412 . . . . 0.0 111.531 170.204 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -56.9 -39.22 74.01 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 118.495 0.589 . . . . 0.0 111.172 -174.237 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 -61.19 -51.04 70.67 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.782 0.833 . . . . 0.0 110.686 175.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.22 -44.9 95.52 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.454 0.702 . . . . 0.0 111.323 -178.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 95.4 mt -54.87 -52.26 44.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 171.08 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.3 -47.43 21.71 Favored Glycine 0 CA--C 1.526 0.759 0 C-N-CA 125.309 1.433 . . . . 0.0 111.929 175.003 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 mt -55.14 -54.74 39.38 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 117.739 0.77 . . . . 0.0 110.43 174.022 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.6 mp -58.84 -44.17 90.89 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 119.344 0.975 . . . . 0.0 111.756 -179.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 88.5 mt -55.94 -56.53 12.24 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 C-N-CA 123.398 0.679 . . . . 0.0 110.304 174.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.19 -50.08 64.15 Favored Glycine 0 CA--C 1.522 0.471 0 N-CA-C 110.046 -1.221 . . . . 0.0 110.046 -176.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 8.8 mm -52.94 -47.86 52.54 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 C-N-CA 123.465 0.706 . . . . 0.0 110.139 175.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -55.25 -65.15 0.64 Allowed 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 118.432 0.56 . . . . 0.0 109.74 177.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 25.5 m-70 -61.92 -26.79 68.39 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 118.41 -0.805 . . . . 0.0 113.018 -172.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 65.1 tttp -49.21 -35.99 18.78 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 119.366 0.984 . . . . 0.0 111.107 171.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 71.7 m-85 -103.6 -56.34 2.23 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 122.994 0.518 . . . . 0.0 110.084 177.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.5 m . . . . . 0 C--O 1.225 -0.231 0 C-N-CA 122.988 0.515 . . . . 0.0 111.924 -176.257 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.449 -0.509 0 CA-C-O 120.916 0.389 . . . . 0.0 110.374 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.56 173.5 15.42 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.099 0.96 . . . . 0.0 109.171 173.057 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 54.5 p -117.94 171.97 7.72 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 123.596 0.759 . . . . 0.0 112.28 -172.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.7 pttm -31.74 -49.17 0.16 Allowed 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 127.197 2.199 . . . . 0.0 113.416 169.28 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.5 -54.83 42.55 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.411 0.624 . . . . 0.0 109.533 -177.109 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.2 mp0 -60.62 -41.91 95.8 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.339 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 69.6 mt -59.16 -48.77 80.37 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 118.447 0.567 . . . . 0.0 111.405 178.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -62.6 -31.57 72.43 Favored 'General case' 0 N--CA 1.457 -0.122 0 C-N-CA 123.397 0.679 . . . . 0.0 110.881 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.43 -68.83 0.34 Allowed 'General case' 0 C--O 1.22 -0.463 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 167.052 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.3 mt -30.13 -65.65 0.11 Allowed 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 126.075 1.75 . . . . 0.0 113.266 -177.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 20.0 tt -59.34 -51.94 66.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.231 -175.105 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -57.84 -45.76 85.74 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 125.208 1.403 . . . . 0.0 111.91 -177.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.0 mmpt? -72.21 -48.89 39.6 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 124.982 1.313 . . . . 0.0 110.263 -175.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -92.58 -52.77 4.48 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.306 0.642 . . . . 0.0 111.052 -169.201 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 31.9 mt . . . . . 0 C--N 1.335 -0.05 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 172.793 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 . . . . . 0 CA--C 1.533 0.299 0 N-CA-C 112.473 0.545 . . . . 0.0 112.473 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.31 -59.99 0.14 Allowed 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 126.984 2.114 . . . . 0.0 114.421 -176.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -63.63 -43.33 97.13 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 121.119 0.485 . . . . 0.0 110.332 -173.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.644 HD12 ' H ' ' A' ' 53' ' ' ILE . 2.5 mp -63.1 -51.2 74.58 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 107.264 -1.384 . . . . 0.0 107.264 -178.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 72.7 t -55.11 -49.32 72.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 C-N-CA 123.554 0.742 . . . . 0.0 109.867 178.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -53.79 -53.07 57.5 Favored 'General case' 0 CA--C 1.527 0.092 0 CA-C-N 118.826 0.739 . . . . 0.0 110.595 176.338 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.4 mt -51.14 -43.0 61.12 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 119.34 -0.362 . . . . 0.0 111.737 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.48 -68.07 0.48 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 118.411 0.55 . . . . 0.0 109.85 175.38 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -43.86 -35.12 1.83 Allowed 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 128.037 2.535 . . . . 0.0 112.689 -174.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -38.39 -48.68 1.38 Allowed 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 124.738 1.215 . . . . 0.0 112.585 171.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -65.21 -36.7 84.99 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 117.877 0.308 . . . . 0.0 111.349 -176.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -71.04 -43.99 66.71 Favored 'General case' 0 C--O 1.226 -0.135 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 179.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 22.5 ttm105 . . . . . 0 CA--C 1.53 0.188 0 C-N-CA 123.195 0.598 . . . . 0.0 110.18 175.918 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 . . . . . 0 CA--C 1.531 0.226 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.6 m -119.13 149.21 21.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 169.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.8 p30 -93.2 169.15 10.61 Favored 'General case' 0 C--O 1.232 0.169 0 C-N-CA 123.677 0.791 . . . . 0.0 110.096 172.115 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -34.63 -59.0 0.48 Allowed 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 124.95 1.3 . . . . 0.0 113.261 176.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 34.6 tp60 -68.2 -29.25 68.05 Favored 'General case' 0 CA--C 1.528 0.116 0 O-C-N 120.848 -1.158 . . . . 0.0 111.464 -173.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.2 -31.7 66.12 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.408 -0.808 . . . . 0.0 110.063 174.085 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -61.16 -47.26 87.02 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.365 -0.834 . . . . 0.0 109.254 167.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 26.5 mm -59.96 -29.48 43.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 O-C-N 121.784 -0.572 . . . . 0.0 110.586 174.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 28.6 m -72.38 -39.15 68.25 Favored 'General case' 0 C--O 1.225 -0.195 0 O-C-N 121.26 -0.9 . . . . 0.0 111.225 172.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 48.1 t80 -58.83 -54.71 43.98 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 118.88 0.764 . . . . 0.0 109.454 174.414 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 29.2 mt -59.46 -44.97 92.88 Favored 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 122.477 0.311 . . . . 0.0 111.068 175.174 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -60.4 -39.86 96.79 Favored Glycine 0 CA--C 1.524 0.651 0 C-N-CA 123.727 0.679 . . . . 0.0 111.464 -178.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.99 -49.64 56.05 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.819 0.848 . . . . 0.0 110.057 176.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -47.38 -53.8 12.9 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.607 0.763 . . . . 0.0 109.731 173.632 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -54.62 -60.65 3.07 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 124.669 1.187 . . . . 0.0 110.6 176.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 53.9 ttm -48.93 -45.28 41.4 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 124.037 0.935 . . . . 0.0 111.333 -178.568 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 57.4 mt -65.82 -60.09 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-O 118.482 -0.77 . . . . 0.0 109.901 -178.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.379 0.0 OUTLIER -76.64 -31.61 57.48 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 113.96 1.096 . . . . 0.0 113.96 -172.67 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.7 m120 -82.39 58.02 3.92 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 169.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -39.53 -40.44 0.86 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 127.251 2.22 . . . . 0.0 115.046 -168.285 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -45.9 -38.41 7.45 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.914 1.286 . . . . 0.0 112.375 178.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 93.0 mt . . . . . 0 CA--C 1.533 0.318 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 179.983 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.319 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.5 m -47.58 156.68 0.63 Allowed Pre-proline 0 CA--C 1.534 0.343 0 C-N-CA 126.245 1.818 . . . . 0.0 112.323 -179.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -41.65 -49.75 5.15 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 123.947 3.098 . . . . 0.0 114.25 -177.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 4.5 mt -56.19 -51.08 69.34 Favored 'General case' 0 N--CA 1.457 -0.111 0 N-CA-C 113.175 0.806 . . . . 0.0 113.175 172.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -61.68 -36.68 81.58 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 118.353 0.524 . . . . 0.0 109.85 -178.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -59.97 -53.8 53.57 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 124.396 1.078 . . . . 0.0 109.551 175.617 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.05 -47.41 86.53 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.102 0.961 . . . . 0.0 111.148 -178.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 72.0 mt -52.84 -53.0 23.37 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 170.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -49.29 -44.57 35.08 Favored Glycine 0 CA--C 1.525 0.676 0 C-N-CA 125.45 1.5 . . . . 0.0 111.882 176.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.1 mt -59.32 -54.45 46.67 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.651 0.78 . . . . 0.0 110.89 174.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 mp -58.49 -43.36 88.97 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 118.911 0.778 . . . . 0.0 111.43 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 85.4 mt -57.73 -52.65 55.04 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.207 0 C-N-CA 123.739 0.816 . . . . 0.0 110.611 173.012 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.25 -50.18 60.63 Favored Glycine 0 CA--C 1.523 0.551 0 N-CA-C 109.788 -1.325 . . . . 0.0 109.788 -177.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.9 mm -54.2 -50.81 53.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 C-N-CA 123.391 0.676 . . . . 0.0 110.387 175.216 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . 0.413 ' HB2' ' CE2' ' B' ' 73' ' ' TYR . 39.7 t80 -53.43 -56.59 15.58 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 121.699 0.762 . . . . 0.0 110.862 177.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 44.1 t60 -63.85 -37.4 87.25 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 124.573 1.149 . . . . 0.0 110.696 -171.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -49.67 -49.3 47.98 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.913 0.885 . . . . 0.0 110.91 175.006 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -88.42 -33.39 17.9 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 122.277 -0.264 . . . . 0.0 111.121 -174.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 14.6 m . . . . . 0 CA--C 1.536 0.414 0 CA-C-N 118.346 0.521 . . . . 0.0 110.721 175.564 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 18.0 m80 . . . . . 0 CA--C 1.538 0.517 0 N-CA-C 109.529 -0.545 . . . . 0.0 109.529 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 59.3 p -139.57 158.61 43.83 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.725 1.61 . . . . 0.0 107.624 172.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -161.4 179.01 8.61 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.057 171.457 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.3 t -135.68 -165.74 1.74 Allowed 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.659 1.118 . . . . 0.0 112.441 -176.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 24.1 pttm -47.14 -52.05 16.52 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 126.575 1.95 . . . . 0.0 112.618 -170.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 18.8 tptp -52.1 -51.31 58.55 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 124.247 1.019 . . . . 0.0 110.825 178.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 27.9 mp0 -69.21 -36.5 77.31 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.282 -176.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 19.2 mt -66.03 -47.67 73.62 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 118.842 0.746 . . . . 0.0 111.429 176.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -57.69 -48.72 78.76 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 175.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 58.2 mt-10 -53.04 -58.34 7.32 Favored 'General case' 0 C--O 1.222 -0.384 0 CA-C-O 119.363 -0.351 . . . . 0.0 110.914 172.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 10.2 mt -44.46 -62.56 1.14 Allowed 'General case' 0 CA--C 1.521 -0.165 0 C-N-CA 124.521 1.128 . . . . 0.0 110.229 179.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 15.3 tt -63.35 -47.01 93.96 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 C-N-CA 120.064 -0.654 . . . . 0.0 110.449 -174.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 16.0 tt0 -60.13 -49.34 78.02 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.409 -0.807 . . . . 0.0 111.717 -177.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -73.85 -52.15 13.94 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.838 0.855 . . . . 0.0 109.766 -175.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -85.15 -18.75 33.19 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -169.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 15.6 mt . . . . . 0 CA--C 1.53 0.192 0 C-N-CA 124.605 1.162 . . . . 0.0 108.364 175.214 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 . . . . . 0 CA--C 1.53 0.187 0 CA-C-O 120.537 0.208 . . . . 0.0 110.556 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -37.69 -56.47 1.06 Allowed 'General case' 0 C--O 1.225 -0.209 0 C-N-CA 125.383 1.473 . . . . 0.0 113.874 -171.002 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -61.21 -40.36 93.67 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.275 0.56 . . . . 0.0 110.88 -175.257 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 53' ' ' ILE . . . . . 0.672 HD12 ' H ' ' B' ' 53' ' ' ILE . 2.4 mp -68.44 -49.85 62.1 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 N-CA-C 106.873 -1.528 . . . . 0.0 106.873 -177.144 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 92.9 t -53.83 -45.06 62.12 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.263 0 C-N-CA 123.239 0.616 . . . . 0.0 110.141 175.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -57.17 -52.74 64.09 Favored 'General case' 0 CA--C 1.527 0.075 0 CA-C-N 118.715 0.689 . . . . 0.0 110.235 175.512 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 30.9 mt -52.51 -41.36 63.37 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 119.038 -0.505 . . . . 0.0 111.419 178.375 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 27.6 mmt -68.94 -61.9 1.61 Allowed 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.926 0.785 . . . . 0.0 109.914 176.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -44.11 -36.38 2.57 Favored 'General case' 0 CA--C 1.522 -0.131 0 C-N-CA 127.724 2.41 . . . . 0.0 111.899 -177.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -38.86 -49.42 1.65 Allowed 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 124.542 1.137 . . . . 0.0 112.061 175.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -57.87 -53.77 54.49 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.342 0.519 . . . . 0.0 109.909 -178.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -60.95 -39.63 90.25 Favored 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 124.352 1.061 . . . . 0.0 111.011 -178.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 36.0 ttm-85 -62.36 -54.94 33.06 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.473 0.709 . . . . 0.0 109.902 178.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 . . . . . 0 CA--C 1.52 -0.206 0 CA-C-O 119.642 -0.218 . . . . 0.0 111.138 -173.4 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 10.7 mp0 . . . . . 0 N--CA 1.453 -0.279 0 N-CA-C 108.625 -0.88 . . . . 0.0 108.625 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 33.7 m -79.58 155.17 4.67 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 172.464 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 3.5 p30 -101.07 171.96 7.31 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.638 0.733 . . . . 0.0 110.527 171.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -31.8 -58.35 0.28 Allowed 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 126.627 1.971 . . . . 0.0 113.65 178.061 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 44.3 tp60 -65.9 -39.14 90.34 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.943 1.247 . . . . 0.0 112.201 -169.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -69.37 -38.78 78.22 Favored 'General case' 0 C--O 1.234 0.248 0 O-C-N 121.57 -0.706 . . . . 0.0 109.732 177.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 73' ' ' TYR . . . . . 0.413 ' CE2' ' HB2' ' B' ' 16' ' ' PHE . 1.0 OUTLIER -54.96 -55.47 30.37 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 171.77 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 19.3 mm -50.59 -48.34 26.89 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.26 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 178.336 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 34.2 m -59.88 -20.87 59.7 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -179.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 15.3 t80 -61.25 -49.31 77.62 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 119.48 1.036 . . . . 0.0 108.398 169.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 44.2 mt -71.3 -39.48 71.43 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.164 0.986 . . . . 0.0 110.936 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -58.31 -50.03 70.47 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.025 -1.23 . . . . 0.0 110.025 176.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.2 -45.68 93.58 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 122.817 0.447 . . . . 0.0 110.638 175.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 14.8 tp -51.46 -56.07 15.35 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.087 0.47 . . . . 0.0 110.075 177.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.42 -58.78 5.31 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 124.323 1.049 . . . . 0.0 109.896 175.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 55.6 ttm -50.63 -44.97 57.51 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.93 0.892 . . . . 0.0 111.315 -176.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 98.6 mt -70.19 -62.3 1.34 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 118.322 -0.846 . . . . 0.0 110.822 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.427 0.1 OUTLIER -71.38 -38.97 71.47 Favored 'General case' 0 C--N 1.347 0.476 0 C-N-CA 118.691 -1.204 . . . . 0.0 112.676 -170.919 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -85.98 62.54 7.51 Favored 'General case' 0 C--N 1.335 -0.048 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 168.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -42.72 -36.84 1.56 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.709 1.604 . . . . 0.0 112.573 -176.233 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -31.87 -49.68 0.18 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 126.804 2.042 . . . . 0.0 112.7 169.506 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 17.3 mt . . . . . 0 C--O 1.226 -0.183 0 C-N-CA 124.561 1.144 . . . . 0.0 112.608 -179.592 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.214 0 CA-C-O 121.866 0.841 . . . . 0.0 110.202 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 14.9 m -64.5 164.5 19.38 Favored Pre-proline 0 CA--C 1.539 0.557 0 C-N-CA 125.137 1.375 . . . . 0.0 110.013 -176.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_exo -47.61 -47.95 16.87 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 123.171 2.58 . . . . 0.0 113.042 -178.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.419 HD23 ' HA ' ' A' ' 5' ' ' LEU . 5.2 mt -56.4 -47.49 78.89 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-O 119.195 -0.431 . . . . 0.0 112.036 173.201 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -61.66 -41.34 97.41 Favored 'General case' 0 C--O 1.227 -0.11 0 CA-C-N 118.717 0.689 . . . . 0.0 109.649 -176.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.5 tt0 -62.03 -49.78 74.64 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 122.855 0.462 . . . . 0.0 110.826 175.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.8 -46.34 89.97 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.534 0.683 . . . . 0.0 111.423 -178.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 68.8 mt -53.7 -52.31 35.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.196 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 170.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.87 -47.35 19.25 Favored Glycine 0 CA--C 1.526 0.769 0 C-N-CA 125.204 1.383 . . . . 0.0 111.88 175.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 mt -55.69 -54.86 39.13 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 117.706 0.753 . . . . 0.0 110.958 173.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.11 -44.35 87.65 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 118.809 0.731 . . . . 0.0 111.742 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.425 HD11 ' HB1' ' B' ' 81' ' ' ALA . 83.1 mt -56.81 -53.8 37.59 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 C-N-CA 123.422 0.689 . . . . 0.0 110.003 174.467 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -53.88 -50.22 55.45 Favored Glycine 0 CA--C 1.523 0.538 0 N-CA-C 110.111 -1.196 . . . . 0.0 110.111 -178.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 7.3 mm -55.33 -46.48 78.29 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 123.269 0.628 . . . . 0.0 110.513 176.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -56.23 -57.88 10.31 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 118.738 0.699 . . . . 0.0 110.233 175.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -56.41 -37.14 69.76 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 124.158 0.983 . . . . 0.0 111.234 -175.352 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -51.04 -32.16 20.77 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.801 1.24 . . . . 0.0 111.903 178.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -108.61 -53.44 2.64 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.108 0.563 . . . . 0.0 110.233 177.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 23.1 t . . . . . 0 CA--C 1.53 0.208 0 C-N-CA 123.458 0.703 . . . . 0.0 110.921 -179.267 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 41.6 p . . . . . 0 N--CA 1.451 -0.382 0 N-CA-C 108.516 -0.92 . . . . 0.0 108.516 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -161.36 170.8 19.42 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.548 1.139 . . . . 0.0 108.212 169.144 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 59.9 p -127.22 173.97 9.31 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 119.343 0.974 . . . . 0.0 112.482 -169.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.4 ptmm? -26.48 -55.9 0.08 Allowed 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 128.339 2.656 . . . . 0.0 114.565 175.074 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -55.63 -55.65 29.58 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 123.457 0.703 . . . . 0.0 110.233 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 7.7 mp0 -62.59 -35.64 80.16 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-O 118.949 -0.548 . . . . 0.0 110.49 -179.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 51.7 mt -66.69 -50.22 63.58 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 118.755 0.707 . . . . 0.0 111.217 178.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -59.77 -43.73 94.22 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 110.094 -0.335 . . . . 0.0 110.094 177.159 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -55.9 -64.83 0.73 Allowed 'General case' 0 C--O 1.219 -0.508 0 CA-C-O 118.467 -0.778 . . . . 0.0 109.646 170.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.3 mt -35.56 -62.16 0.42 Allowed 'General case' 0 N--CA 1.461 0.112 0 C-N-CA 125.42 1.488 . . . . 0.0 111.499 179.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 9.2 tt -60.81 -51.58 71.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 120.292 -0.563 . . . . 0.0 109.866 -174.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -60.61 -42.4 96.76 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.588 -0.695 . . . . 0.0 112.443 -177.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -72.67 -55.04 7.42 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.93 1.292 . . . . 0.0 109.534 -175.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -85.97 -24.97 26.3 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.735 0.814 . . . . 0.0 113.005 -168.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 67.9 mt . . . . . 0 C--N 1.338 0.099 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 168.441 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.0 p30 . . . . . 0 N--CA 1.462 0.125 0 CA-C-O 119.237 -0.411 . . . . 0.0 111.283 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -34.16 -57.98 0.47 Allowed 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 125.181 1.392 . . . . 0.0 113.81 -173.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 77.1 tt0 -66.04 -40.94 91.42 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.975 0.51 . . . . 0.0 111.486 -174.092 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.603 HD12 ' H ' ' A' ' 53' ' ' ILE . 2.2 mp -63.05 -52.69 56.0 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.46 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 -179.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 77.6 t -54.36 -48.27 68.42 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 C-N-CA 123.975 0.91 . . . . 0.0 109.877 177.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -53.56 -52.94 58.1 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 118.871 0.759 . . . . 0.0 111.112 177.091 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 30.9 mt -52.59 -42.88 64.92 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 119.378 -0.344 . . . . 0.0 111.462 -179.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.52 -63.54 1.1 Allowed 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 118.457 0.571 . . . . 0.0 109.873 176.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -38.93 -46.35 1.3 Allowed 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 127.327 2.251 . . . . 0.0 111.818 -177.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -38.91 -48.81 1.62 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.701 1.2 . . . . 0.0 112.6 177.064 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.1 mp -57.39 -51.56 68.91 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 -177.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -65.94 -40.99 91.87 Favored 'General case' 0 C--O 1.225 -0.231 0 C-N-CA 122.654 0.382 . . . . 0.0 110.764 179.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 12.7 ttp180 . . . . . 0 N--CA 1.453 -0.284 0 C-N-CA 122.842 0.457 . . . . 0.0 110.568 -178.072 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 21.1 mp0 . . . . . 0 N--CA 1.45 -0.473 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.7 m -83.19 150.71 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 176.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -89.64 177.07 6.63 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 123.267 0.627 . . . . 0.0 110.693 175.058 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -44.43 -60.86 1.75 Allowed 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.84 0.856 . . . . 0.0 111.861 174.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.0 tp60 -62.49 -35.81 80.53 Favored 'General case' 0 C--O 1.225 -0.19 0 CA-C-N 119.376 0.989 . . . . 0.0 111.822 -173.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -65.51 -40.53 93.12 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 119.519 1.054 . . . . 0.0 111.277 174.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -55.62 -51.77 66.07 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.801 -0.562 . . . . 0.0 109.525 170.345 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 29.0 mm -56.53 -39.91 65.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 O-C-N 122.029 -0.419 . . . . 0.0 110.335 177.216 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 84.8 m -64.19 -39.59 94.31 Favored 'General case' 0 C--O 1.226 -0.151 0 O-C-N 121.614 -0.679 . . . . 0.0 110.384 178.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -55.27 -53.33 57.45 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 173.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 61.7 mt -60.32 -42.35 95.42 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.673 -0.24 . . . . 0.0 111.572 177.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -62.31 -46.9 92.93 Favored Glycine 0 CA--C 1.526 0.768 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 -179.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.6 -48.83 77.72 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 122.173 -0.604 . . . . 0.0 109.758 177.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 16.7 tp -50.37 -57.96 6.78 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.72 0.772 . . . . 0.0 110.029 176.052 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.447 ' HB1' HD11 ' B' ' 13' ' ' ILE . . . -48.42 -54.88 12.46 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 125.109 1.364 . . . . 0.0 109.955 177.772 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 9.1 ttp -59.99 -48.31 82.24 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 123.342 0.657 . . . . 0.0 111.655 -176.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.404 HD13 HG21 ' A' ' 83' ' ' ILE . 93.7 mt -59.55 -54.28 36.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 CA-C-O 118.135 -0.936 . . . . 0.0 110.128 -179.033 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.439 1.3 p90 -76.41 -38.72 55.18 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 120.097 1.317 . . . . 0.0 113.309 -175.742 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 27.8 m-80 -79.88 74.19 6.62 Favored 'General case' 0 N--CA 1.463 0.206 0 O-C-N 121.008 -1.058 . . . . 0.0 108.552 173.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -36.33 -43.19 0.36 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.309 1.444 . . . . 0.0 113.512 176.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -39.97 -41.96 1.29 Allowed 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.11 1.764 . . . . 0.0 113.54 174.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 47.6 mt . . . . . 0 CA--C 1.528 0.129 0 CA-C-O 118.864 -0.589 . . . . 0.0 112.349 -178.505 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.265 0 CA-C-O 120.81 0.338 . . . . 0.0 111.005 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.1 m -54.89 163.23 1.53 Allowed Pre-proline 0 CA--C 1.54 0.587 0 C-N-CA 124.686 1.194 . . . . 0.0 111.698 175.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -46.89 -50.33 10.99 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 123.597 2.864 . . . . 0.0 113.185 179.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.2 mt -54.73 -48.6 72.34 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-O 119.476 -0.297 . . . . 0.0 111.535 173.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -61.4 -42.38 98.63 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 118.315 0.507 . . . . 0.0 109.973 -176.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.2 tp60 -63.64 -47.22 82.23 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 122.367 0.267 . . . . 0.0 110.922 176.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.5 -47.19 82.75 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 121.339 0.59 . . . . 0.0 110.869 -178.012 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 69.5 mt -52.68 -55.34 11.76 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.248 0 N-CA-C 108.075 -1.084 . . . . 0.0 108.075 169.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -45.77 -45.97 13.41 Favored Glycine 0 CA--C 1.526 0.772 0 C-N-CA 125.352 1.453 . . . . 0.0 112.079 177.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.2 mt -55.72 -55.92 26.6 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.493 0.717 . . . . 0.0 110.782 173.371 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.9 mp -58.51 -43.03 88.97 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 118.898 0.772 . . . . 0.0 111.863 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . 0.447 HD11 ' HB1' ' A' ' 81' ' ' ALA . 52.1 mt -57.48 -57.76 8.88 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 C-N-CA 123.435 0.694 . . . . 0.0 109.938 174.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.06 -48.84 61.53 Favored Glycine 0 CA--C 1.521 0.421 0 N-CA-C 109.968 -1.253 . . . . 0.0 109.968 -177.164 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 5.8 mm -54.22 -46.88 68.32 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 C-N-CA 123.515 0.726 . . . . 0.0 110.878 175.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -56.62 -61.42 2.44 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 118.719 0.69 . . . . 0.0 109.32 175.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -55.02 -37.33 66.51 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.727 0.811 . . . . 0.0 111.771 -173.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -45.68 -38.95 7.35 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.289 1.435 . . . . 0.0 111.197 175.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -101.56 -60.15 1.58 Allowed 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 176.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.5 m . . . . . 0 C--N 1.338 0.091 0 C-N-CA 123.845 0.858 . . . . 0.0 112.617 -173.061 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 11.9 t-80 . . . . . 0 CA--C 1.535 0.399 0 CA-C-O 120.217 0.056 . . . . 0.0 110.994 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 1.1 p -129.65 160.99 31.62 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 125.374 1.469 . . . . 0.0 110.715 -173.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -156.51 161.37 40.02 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.081 0.552 . . . . 0.0 111.449 169.496 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 75.5 m -108.2 158.76 17.16 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.649 1.18 . . . . 0.0 113.145 -174.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 14.5 ptpt -22.64 -58.35 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 129.048 2.939 . . . . 0.0 115.397 179.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 18.2 tppt? -46.52 -50.04 17.72 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.24 1.016 . . . . 0.0 111.094 179.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 80.1 mt-10 -69.67 -27.94 65.45 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 119.037 -0.506 . . . . 0.0 111.847 -178.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 19.7 mt -73.9 -46.37 44.92 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 119.153 0.888 . . . . 0.0 110.049 176.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 39.0 mttp -56.16 -47.87 77.41 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 172.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -55.04 -56.62 17.77 Favored 'General case' 0 C--O 1.223 -0.336 0 CA-C-O 119.044 -0.503 . . . . 0.0 111.037 172.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 11.1 mt -45.95 -59.56 2.76 Favored 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 123.38 0.672 . . . . 0.0 110.299 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 15.5 tt -62.91 -50.76 78.36 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 C-N-CA 119.8 -0.76 . . . . 0.0 110.197 -177.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -59.35 -51.1 71.39 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.078 -1.014 . . . . 0.0 112.302 -175.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.1 -52.82 12.82 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.736 0.815 . . . . 0.0 110.208 -177.091 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -88.99 -18.15 27.97 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 -167.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 42.6 mt . . . . . 0 CA--C 1.526 0.054 0 C-N-CA 125.255 1.422 . . . . 0.0 107.874 172.843 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 18.1 p-10 . . . . . 0 C--O 1.225 -0.231 0 CA-C-O 119.675 -0.203 . . . . 0.0 111.054 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -42.52 -54.45 3.9 Favored 'General case' 0 C--O 1.225 -0.188 0 C-N-CA 123.912 0.885 . . . . 0.0 113.182 -169.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -59.42 -43.46 93.05 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.675 0.79 . . . . 0.0 110.848 -178.058 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 53' ' ' ILE . . . . . 0.56 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.2 mp -63.22 -52.53 57.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 N-CA-C 106.927 -1.508 . . . . 0.0 106.927 -178.389 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 84.7 t -56.72 -43.93 80.43 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 C-N-CA 124.248 1.019 . . . . 0.0 110.295 179.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -57.29 -53.7 55.17 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 119.023 0.829 . . . . 0.0 110.03 175.13 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 30.8 mt -51.88 -44.16 63.62 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 119.184 -0.436 . . . . 0.0 111.088 178.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 27.2 mmt -65.97 -65.31 0.69 Allowed 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 109.524 -0.546 . . . . 0.0 109.524 176.116 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -40.72 -43.09 1.89 Allowed 'General case' 0 CA--C 1.52 -0.196 0 C-N-CA 127.826 2.45 . . . . 0.0 111.89 -175.155 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -38.7 -48.76 1.52 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.21 1.004 . . . . 0.0 112.312 176.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.4 pp -61.85 -37.84 85.99 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 117.915 0.325 . . . . 0.0 111.479 -175.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -76.18 -47.15 25.19 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 179.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 14.1 ttm180 -50.57 -41.46 54.34 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.244 0.617 . . . . 0.0 110.283 177.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 . . . . . 0 CA--C 1.532 0.275 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -179.714 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 . . . . . 0 N--CA 1.451 -0.386 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 5.3 m -118.77 149.86 21.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 C-N-CA 124.991 1.316 . . . . 0.0 107.619 172.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -86.84 174.62 8.66 Favored 'General case' 0 CA--C 1.527 0.093 0 C-N-CA 124.272 1.029 . . . . 0.0 111.79 176.219 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 49.3 t80 -46.31 -61.91 1.58 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.717 0.807 . . . . 0.0 113.156 178.015 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 10.1 tp-100 -63.8 -32.49 74.02 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 120.183 1.356 . . . . 0.0 111.071 -177.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -62.61 -41.7 99.14 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 119.533 1.061 . . . . 0.0 110.938 175.079 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -57.96 -50.51 73.14 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.769 -0.582 . . . . 0.0 109.892 169.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 23.9 mm -60.18 -25.21 32.79 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 O-C-N 121.655 -0.653 . . . . 0.0 111.04 176.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 60.8 m -77.88 -32.94 52.15 Favored 'General case' 0 C--O 1.224 -0.24 0 O-C-N 120.917 -1.115 . . . . 0.0 110.37 173.4 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 30.8 t80 -58.46 -55.25 37.47 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 170.293 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 53.1 mt -63.09 -43.19 99.21 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 121.411 0.624 . . . . 0.0 111.7 178.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.88 -43.7 97.18 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.685 -0.966 . . . . 0.0 110.685 -177.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.29 -46.74 85.37 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 123.186 0.595 . . . . 0.0 110.031 174.253 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 13.8 tp -49.55 -56.18 10.82 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.426 0.631 . . . . 0.0 109.963 175.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . 0.425 ' HB1' HD11 ' A' ' 13' ' ' ILE . . . -51.81 -58.63 5.87 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 114.624 -1.171 . . . . 0.0 110.384 177.438 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 48.3 ttm -51.01 -48.4 61.43 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 124.889 1.276 . . . . 0.0 110.983 -177.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 76.6 mt -63.8 -66.07 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 CA-C-O 118.8 -0.619 . . . . 0.0 109.458 -178.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.381 0.7 OUTLIER -70.13 -31.29 68.74 Favored 'General case' 0 C--N 1.345 0.411 0 C-N-CA 117.941 -1.504 . . . . 0.0 112.715 -169.764 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 22.5 m-80 -80.61 71.73 7.5 Favored 'General case' 0 C--O 1.231 0.12 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 170.03 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -35.75 -45.22 0.37 Allowed 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 125.821 1.648 . . . . 0.0 112.158 178.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -35.74 -48.61 0.55 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.968 1.707 . . . . 0.0 113.426 174.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 96.4 mt . . . . . 0 CA--C 1.532 0.26 0 C-N-CA 123.002 0.521 . . . . 0.0 112.393 -176.332 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.453 -0.284 0 CA-C-O 121.0 0.429 . . . . 0.0 110.917 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.4 t -44.87 155.63 0.39 Allowed Pre-proline 0 CA--C 1.534 0.336 0 C-N-CA 124.989 1.316 . . . . 0.0 111.08 169.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -50.23 -38.92 52.45 Favored 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 122.331 2.021 . . . . 0.0 111.533 169.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.9 mt -61.28 -54.0 49.62 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 118.649 0.659 . . . . 0.0 110.142 173.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -58.35 -38.96 78.26 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 117.656 0.207 . . . . 0.0 110.832 -175.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 15.1 tt0 -64.02 -52.3 60.12 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 124.783 1.233 . . . . 0.0 110.615 176.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.34 -45.42 91.29 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 121.367 0.603 . . . . 0.0 111.098 -178.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 68.0 mt -52.63 -52.63 25.43 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 169.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.4 -47.47 16.78 Favored Glycine 0 CA--C 1.528 0.893 0 C-N-CA 125.204 1.383 . . . . 0.0 112.202 174.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.6 mt -56.89 -55.31 36.08 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 117.95 0.875 . . . . 0.0 110.8 174.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.9 mp -59.37 -42.8 92.47 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 118.707 0.685 . . . . 0.0 111.7 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 73.5 mt -55.94 -56.82 10.71 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.167 0 C-N-CA 123.959 0.904 . . . . 0.0 109.746 172.659 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.29 -48.58 63.5 Favored Glycine 0 CA--C 1.522 0.518 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 -176.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 6.3 mm -54.73 -46.63 74.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 C-N-CA 123.396 0.678 . . . . 0.0 110.527 175.166 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -57.95 -53.45 58.04 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.645 0.736 . . . . 0.0 110.187 175.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.5 t-80 -57.43 -36.61 71.58 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.673 0.789 . . . . 0.0 111.302 -175.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.8 ttmm -52.86 -28.5 23.29 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.026 1.33 . . . . 0.0 111.87 178.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 61.3 m-85 -117.61 -73.52 0.64 Allowed 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.36 0.664 . . . . 0.0 109.602 176.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.455 -0.182 0 C-N-CA 124.513 1.125 . . . . 0.0 110.432 -175.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.5 p . . . . . 0 CA--C 1.53 0.191 0 CA-C-O 121.161 0.505 . . . . 0.0 112.178 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.48 -172.31 3.5 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.411 1.484 . . . . 0.0 108.178 171.178 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 8.6 t -148.17 -168.93 3.21 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 119.899 1.227 . . . . 0.0 111.828 178.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 49.0 pttt -35.15 -57.14 0.58 Allowed 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 128.992 2.917 . . . . 0.0 114.376 -173.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 23.1 ttmm -58.3 -52.37 65.88 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 -177.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -63.22 -40.48 97.59 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.274 -176.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.2 mt -59.77 -52.71 64.32 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 118.133 0.424 . . . . 0.0 111.178 175.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 35.3 mtmm -59.91 -43.36 94.92 Favored 'General case' 0 CA--C 1.531 0.212 0 O-C-N 122.202 -0.311 . . . . 0.0 110.706 -179.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 85.1 mt-10 -56.87 -60.22 3.89 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-O 118.746 -0.645 . . . . 0.0 109.8 172.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.0 mt -40.11 -60.6 1.02 Allowed 'General case' 0 N--CA 1.461 0.096 0 C-N-CA 124.481 1.113 . . . . 0.0 111.323 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 18.3 tt -60.94 -51.54 72.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 C-N-CA 120.179 -0.608 . . . . 0.0 110.29 -177.068 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -59.92 -47.55 85.3 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 118.868 0.758 . . . . 0.0 111.815 -175.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.2 mmpt? -67.95 -57.98 5.29 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 125.539 1.535 . . . . 0.0 109.642 -176.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -83.25 -49.23 9.63 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.198 -168.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 15.0 mt . . . . . 0 C--O 1.231 0.086 0 N-CA-C 108.056 -1.091 . . . . 0.0 108.056 171.207 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.1 p30 . . . . . 0 CA--C 1.528 0.133 0 CA-C-O 119.463 -0.303 . . . . 0.0 111.761 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.92 -60.5 0.16 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.124 1.77 . . . . 0.0 115.115 -176.2 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -62.55 -40.18 95.99 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-O 121.421 0.629 . . . . 0.0 110.845 -174.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.649 HD12 ' H ' ' A' ' 53' ' ' ILE . 3.4 mp -67.54 -48.42 76.94 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 -178.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 84.6 t -55.13 -44.66 75.53 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.36 0 CA-C-O 118.791 -0.623 . . . . 0.0 110.294 176.357 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -57.09 -52.68 64.33 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 119.339 0.972 . . . . 0.0 110.577 174.01 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 39.7 mt -52.99 -42.12 65.26 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 119.06 -0.495 . . . . 0.0 111.557 178.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 25.4 mmt -68.63 -61.56 1.77 Allowed 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.886 0.766 . . . . 0.0 109.554 176.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -46.12 -36.04 5.51 Favored 'General case' 0 CA--C 1.521 -0.143 0 C-N-CA 127.639 2.375 . . . . 0.0 111.973 -176.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -39.16 -56.75 1.43 Allowed 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.831 0.853 . . . . 0.0 111.605 170.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.25 -50.08 74.85 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 -176.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -58.25 -54.9 41.73 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.522 0.729 . . . . 0.0 111.189 -177.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 16.9 ptt180 . . . . . 0 N--CA 1.454 -0.266 0 O-C-N 122.493 -0.129 . . . . 0.0 110.789 -173.154 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.8 mp0 . . . . . 0 N--CA 1.451 -0.38 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 33.9 m -105.73 154.56 6.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 108.239 -1.022 . . . . 0.0 108.239 170.071 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -93.35 178.11 5.82 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 123.946 0.898 . . . . 0.0 110.967 177.114 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 50.3 t80 -40.51 -65.41 0.42 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.756 1.222 . . . . 0.0 112.538 172.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -61.21 -36.54 80.19 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 120.074 1.306 . . . . 0.0 111.844 -175.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 -66.55 -32.87 74.48 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 120.956 -1.09 . . . . 0.0 111.628 176.089 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -61.61 -51.89 66.65 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 121.19 -0.944 . . . . 0.0 108.559 168.499 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 21.3 mm -53.02 -39.69 33.91 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.364 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 177.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 54.6 m -59.1 -32.83 70.18 Favored 'General case' 0 C--O 1.226 -0.167 0 C-N-CA 123.744 0.818 . . . . 0.0 111.301 177.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -56.97 -50.55 72.3 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 171.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 42.9 mt -69.83 -39.82 76.24 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.018 0.927 . . . . 0.0 111.755 -177.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.72 -43.04 77.45 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 109.925 -1.27 . . . . 0.0 109.925 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.47 -45.95 88.44 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 122.104 -0.644 . . . . 0.0 110.202 173.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 10.0 tp -50.53 -57.69 7.54 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.04 0.536 . . . . 0.0 109.708 173.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -49.67 -54.14 20.36 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 124.072 0.949 . . . . 0.0 110.533 177.12 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 48.1 ttm -56.16 -47.94 77.27 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 124.248 1.019 . . . . 0.0 110.906 -177.116 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 85.5 mt -65.48 -55.43 20.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.477 -177.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.444 0.1 OUTLIER -75.22 -35.8 61.44 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 119.911 1.232 . . . . 0.0 112.997 -174.408 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 31.9 m-80 -81.75 72.85 8.8 Favored 'General case' 0 N--CA 1.461 0.105 0 O-C-N 120.942 -1.099 . . . . 0.0 108.123 170.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -30.17 -50.77 0.13 Allowed 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 126.633 1.973 . . . . 0.0 112.837 -179.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -34.11 -54.46 0.49 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.202 1.801 . . . . 0.0 113.146 174.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 94.7 mt . . . . . 0 N--CA 1.454 -0.249 0 C-N-CA 124.086 0.954 . . . . 0.0 113.245 -173.617 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.267 0 CA-C-O 121.267 0.556 . . . . 0.0 110.066 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -71.07 170.29 11.94 Favored Pre-proline 0 CA--C 1.539 0.526 0 C-N-CA 124.616 1.167 . . . . 0.0 111.101 -169.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -49.09 -49.01 16.37 Favored 'Trans proline' 0 N--CA 1.459 -0.554 0 C-N-CA 123.313 2.675 . . . . 0.0 112.428 179.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.5 mt -53.7 -50.9 64.88 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 119.32 -0.372 . . . . 0.0 111.551 172.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -59.38 -41.23 88.86 Favored 'General case' 0 C--O 1.227 -0.11 0 CA-C-N 118.539 0.608 . . . . 0.0 110.285 -177.376 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -61.66 -50.32 72.98 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 122.832 0.453 . . . . 0.0 110.69 176.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.21 -46.13 90.8 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.597 0.759 . . . . 0.0 111.164 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 78.5 mt -55.64 -50.87 64.18 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 172.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.69 -47.68 18.11 Favored Glycine 0 CA--C 1.527 0.787 0 C-N-CA 125.295 1.426 . . . . 0.0 111.896 174.438 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.3 mt -55.52 -54.59 42.06 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 117.538 0.669 . . . . 0.0 111.087 173.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.5 mp -58.21 -42.76 86.93 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 118.851 0.751 . . . . 0.0 111.616 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 97.4 mt -56.98 -53.32 44.48 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.168 0 C-N-CA 123.204 0.602 . . . . 0.0 110.082 173.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.77 -50.06 59.42 Favored Glycine 0 CA--C 1.522 0.525 0 N-CA-C 110.33 -1.108 . . . . 0.0 110.33 -178.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.8 mm -55.02 -45.84 76.96 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 C-N-CA 122.607 0.363 . . . . 0.0 110.28 175.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 39.7 t80 -56.94 -57.8 10.92 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 118.537 0.608 . . . . 0.0 110.111 176.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -51.66 -41.39 61.33 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 124.497 1.119 . . . . 0.0 111.128 -177.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 65.3 tttp -50.24 -32.63 17.12 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.337 1.055 . . . . 0.0 112.293 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -113.66 -55.17 2.54 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.495 0.718 . . . . 0.0 110.643 179.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 4.6 t . . . . . 0 C--O 1.232 0.139 0 C-N-CA 124.159 0.984 . . . . 0.0 111.247 -178.481 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 16.8 t-160 . . . . . 0 CA--C 1.539 0.523 0 CA-C-O 119.551 -0.261 . . . . 0.0 110.343 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 35.9 p -122.34 153.09 39.45 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 124.723 1.209 . . . . 0.0 112.609 -179.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -155.12 -174.68 5.08 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.672 1.589 . . . . 0.0 107.919 170.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 9.1 t -147.02 -167.47 2.78 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 120.155 1.343 . . . . 0.0 112.63 -177.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -39.96 -53.87 2.28 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 127.725 2.41 . . . . 0.0 113.474 -169.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -56.87 -50.57 72.09 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 123.015 0.526 . . . . 0.0 110.754 -179.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 19.4 mp0 -65.48 -38.1 88.78 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 -177.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 31.6 mt -66.45 -51.26 58.75 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 118.214 0.461 . . . . 0.0 111.268 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -54.91 -48.96 72.38 Favored 'General case' 0 N--CA 1.456 -0.175 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 176.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -52.61 -60.55 3.11 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 119.062 -0.494 . . . . 0.0 111.019 173.164 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 9.1 mt -43.04 -64.19 0.67 Allowed 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 124.466 1.106 . . . . 0.0 110.494 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 18.3 tt -63.22 -51.09 75.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 119.677 -0.809 . . . . 0.0 110.491 -174.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -67.91 -33.51 74.84 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.405 -0.809 . . . . 0.0 112.549 -171.267 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.43 -68.16 0.67 Allowed 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 174.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 60.8 mm-40 -64.25 -44.38 91.96 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 122.158 -0.339 . . . . 0.0 110.667 -168.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 26.3 mt . . . . . 0 N--CA 1.456 -0.144 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 172.235 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 . . . . . 0 C--O 1.226 -0.166 0 N-CA-C 109.946 -0.39 . . . . 0.0 109.946 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -33.55 -60.83 0.35 Allowed 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 125.87 1.668 . . . . 0.0 114.142 -178.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 62.8 tt0 -58.91 -41.39 87.14 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-O 120.959 0.409 . . . . 0.0 110.852 -178.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 53' ' ' ILE . . . . . 0.516 ' H ' ' CD1' ' B' ' 53' ' ' ILE . 0.8 OUTLIER -64.59 -53.23 44.91 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.644 0 N-CA-C 106.665 -1.606 . . . . 0.0 106.665 -175.363 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 92.2 t -54.9 -45.58 75.62 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 C-N-CA 124.168 0.987 . . . . 0.0 110.082 177.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -55.75 -53.17 59.88 Favored 'General case' 0 CA--C 1.528 0.106 0 CA-C-N 118.538 0.608 . . . . 0.0 110.876 174.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 60.3 mt -55.85 -39.86 72.04 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 118.97 -0.538 . . . . 0.0 111.153 179.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 26.4 mmt -65.78 -65.6 0.66 Allowed 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.859 0.754 . . . . 0.0 109.186 174.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -39.3 -45.93 1.49 Allowed 'General case' 0 N--CA 1.461 0.124 0 C-N-CA 127.393 2.277 . . . . 0.0 111.892 -178.315 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -38.95 -48.3 1.57 Allowed 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 125.127 1.371 . . . . 0.0 112.227 178.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.2 pp -60.04 -39.89 87.52 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-O 119.641 -0.218 . . . . 0.0 110.827 -175.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -80.26 -42.81 22.47 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 123.005 0.522 . . . . 0.0 110.506 -178.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 54.7 ttm-85 -53.65 -45.73 70.32 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.328 0.651 . . . . 0.0 110.037 177.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 14.5 m-80 . . . . . 0 N--CA 1.456 -0.146 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 178.38 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 26.6 mp0 . . . . . 0 N--CA 1.452 -0.37 0 N-CA-C 109.548 -0.538 . . . . 0.0 109.548 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 15.3 m -115.97 153.05 17.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 N-CA-C 106.106 -1.813 . . . . 0.0 106.106 167.369 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -96.82 174.83 6.6 Favored 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 123.085 0.554 . . . . 0.0 110.728 174.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -39.9 -60.23 1.05 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.065 0.946 . . . . 0.0 112.54 171.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 61.4 tp60 -60.48 -39.28 87.09 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 119.827 1.194 . . . . 0.0 111.835 -176.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 50.6 mm-40 -62.84 -41.37 99.32 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.322 -0.861 . . . . 0.0 111.339 174.141 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -56.7 -48.88 76.7 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.44 -0.787 . . . . 0.0 109.718 172.434 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 26.2 mm -59.42 -34.39 54.27 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 C-N-CA 123.725 0.81 . . . . 0.0 110.552 176.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 74.5 m -67.01 -41.91 85.88 Favored 'General case' 0 C--O 1.227 -0.121 0 O-C-N 121.479 -0.763 . . . . 0.0 110.204 174.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -56.72 -52.04 66.48 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.432 0.693 . . . . 0.0 109.225 174.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 44.0 mt -58.83 -44.64 90.96 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 122.246 -0.284 . . . . 0.0 111.59 175.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -59.5 -46.13 94.45 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 -179.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.09 -48.96 77.86 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 123.395 0.678 . . . . 0.0 109.804 176.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -50.69 -58.5 5.73 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-O 122.176 0.988 . . . . 0.0 109.733 176.201 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -48.69 -55.63 10.81 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 125.368 1.467 . . . . 0.0 110.742 178.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 19.7 ttp -66.58 -39.63 88.54 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.458 0.703 . . . . 0.0 112.087 -175.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 63.6 mt -65.49 -43.99 94.25 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 CA-C-O 118.02 -0.99 . . . . 0.0 110.079 -177.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.463 0.9 OUTLIER -78.75 -40.06 34.45 Favored 'General case' 0 C--N 1.347 0.459 0 C-N-CA 118.363 -1.335 . . . . 0.0 113.349 175.132 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -80.09 66.84 5.71 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 120.853 -1.154 . . . . 0.0 108.732 170.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -38.06 -42.65 0.67 Allowed 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.739 1.616 . . . . 0.0 113.328 -177.456 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -32.34 -55.07 0.33 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.25 1.82 . . . . 0.0 112.854 170.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 89.2 mt . . . . . 0 C--O 1.222 -0.368 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 -173.213 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.23 0 CA-C-O 121.546 0.688 . . . . 0.0 110.907 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.08 168.18 1.68 Allowed Pre-proline 0 CA--C 1.538 0.503 0 C-N-CA 126.598 1.959 . . . . 0.0 112.246 -178.384 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -49.05 -51.54 10.4 Favored 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 123.297 2.665 . . . . 0.0 112.491 174.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.423 HD23 ' HA ' ' A' ' 5' ' ' LEU . 5.8 mt -58.26 -49.18 78.02 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 119.436 -0.316 . . . . 0.0 110.705 176.597 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -54.99 -47.76 74.21 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -177.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 16.0 tt0 -59.72 -51.66 68.84 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.884 0.874 . . . . 0.0 110.757 177.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.33 -46.68 85.52 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.464 0.706 . . . . 0.0 111.725 -175.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 75.2 mt -54.21 -53.19 31.19 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 N-CA-C 107.958 -1.126 . . . . 0.0 107.958 170.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -45.6 -47.64 12.6 Favored Glycine 0 CA--C 1.529 0.92 0 C-N-CA 124.742 1.163 . . . . 0.0 112.087 175.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 mt -56.62 -54.3 47.63 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.785 0.834 . . . . 0.0 111.007 174.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.4 mp -60.03 -44.25 94.77 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.067 0.849 . . . . 0.0 111.743 -179.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 67.7 mt -56.18 -55.67 17.35 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 C-N-CA 123.238 0.615 . . . . 0.0 109.733 173.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -52.77 -50.73 48.54 Favored Glycine 0 CA--C 1.521 0.417 0 N-CA-C 110.03 -1.228 . . . . 0.0 110.03 -177.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.7 mm -55.0 -48.44 75.74 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 C-N-CA 123.03 0.532 . . . . 0.0 110.443 176.054 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -55.16 -56.15 23.2 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 118.668 0.667 . . . . 0.0 110.245 177.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -64.28 -31.96 73.37 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 123.19 0.596 . . . . 0.0 111.5 -172.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -49.77 -43.84 48.48 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.544 1.138 . . . . 0.0 110.828 176.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 94.5 m-85 -96.12 -56.05 2.77 Favored 'General case' 0 CA--C 1.529 0.138 0 N-CA-C 109.624 -0.509 . . . . 0.0 109.624 179.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.8 m . . . . . 0 C--O 1.224 -0.267 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -175.572 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.4 p . . . . . 0 N--CA 1.447 -0.616 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -161.61 163.2 30.12 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.829 0.852 . . . . 0.0 108.73 168.77 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 10.6 t -116.96 -169.64 1.68 Allowed 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.229 0.922 . . . . 0.0 112.639 -174.063 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -38.61 -65.49 0.35 Allowed 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 128.942 2.897 . . . . 0.0 113.252 -171.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 30.1 tttm -56.14 -43.54 78.36 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.386 0.674 . . . . 0.0 110.742 -174.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -66.41 -39.44 88.99 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 123.697 0.799 . . . . 0.0 110.387 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 45.8 mt -63.1 -50.65 69.66 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 118.123 0.42 . . . . 0.0 110.822 174.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 36.3 mttp -53.42 -49.26 67.69 Favored 'General case' 0 C--O 1.233 0.185 0 C-N-CA 123.584 0.754 . . . . 0.0 110.061 176.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 53.2 tt0 -51.56 -69.56 0.11 Allowed 'General case' 0 C--O 1.223 -0.335 0 CA-C-O 118.308 -0.853 . . . . 0.0 109.196 171.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.6 mt -35.26 -63.47 0.33 Allowed 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 124.126 0.971 . . . . 0.0 112.476 178.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 14.7 tt -63.85 -45.27 97.54 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-O 119.118 -0.468 . . . . 0.0 110.579 -171.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.0 tt0 -70.42 -44.75 67.28 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 118.856 0.753 . . . . 0.0 111.904 -176.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.7 mmpt? -54.85 -58.35 7.94 Favored 'General case' 0 N--CA 1.458 -0.069 0 C-N-CA 124.236 1.015 . . . . 0.0 109.103 175.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -79.56 -66.66 0.84 Allowed 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.715 -171.126 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 95.9 mt . . . . . 0 N--CA 1.453 -0.31 0 O-C-N 121.615 -0.678 . . . . 0.0 109.916 -175.067 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 . . . . . 0 CA--C 1.534 0.338 0 N-CA-C 114.552 1.316 . . . . 0.0 114.552 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -38.64 -56.2 1.35 Allowed 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.442 1.497 . . . . 0.0 113.737 -173.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -63.44 -38.93 93.04 Favored 'General case' 0 N--CA 1.461 0.106 0 CA-C-O 121.267 0.556 . . . . 0.0 110.709 -174.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.656 HD12 ' H ' ' A' ' 53' ' ' ILE . 3.0 mp -68.65 -49.47 64.42 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.705 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 -175.484 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 71.6 t -53.5 -47.39 59.6 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 C-N-CA 123.342 0.657 . . . . 0.0 110.172 173.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.54 -52.63 63.06 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.73 0.695 . . . . 0.0 110.607 176.212 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.1 mt -55.27 -40.47 71.03 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.266 0.626 . . . . 0.0 111.547 -178.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.24 -61.49 1.77 Allowed 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 118.563 0.62 . . . . 0.0 109.645 174.491 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -46.61 -34.0 4.63 Favored 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 126.5 1.92 . . . . 0.0 112.269 -176.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -38.12 -50.39 1.38 Allowed 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 125.302 1.441 . . . . 0.0 111.43 173.212 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -53.03 -60.53 3.17 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 122.81 0.444 . . . . 0.0 109.872 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -63.34 -40.28 96.85 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.569 0.747 . . . . 0.0 111.467 -174.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.534 0.344 0 CA-C-O 119.485 -0.293 . . . . 0.0 111.761 -173.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.5 pm0 . . . . . 0 N--CA 1.448 -0.539 0 CA-C-O 120.684 0.278 . . . . 0.0 111.312 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 20.5 m -107.69 149.1 11.31 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 C-N-CA 126.034 1.734 . . . . 0.0 108.303 174.349 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -87.68 168.93 12.56 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.335 0.654 . . . . 0.0 111.283 175.214 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -33.59 -63.0 0.27 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.688 1.195 . . . . 0.0 112.963 172.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 45.2 tp60 -62.49 -31.46 72.22 Favored 'General case' 0 CA--C 1.533 0.292 0 O-C-N 120.753 -1.217 . . . . 0.0 111.839 -174.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -71.8 -37.74 70.36 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.261 -0.899 . . . . 0.0 110.199 176.2 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -56.67 -49.86 73.81 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 169.666 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 26.9 mm -56.59 -41.43 73.5 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 175.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 60.1 m -59.22 -41.7 89.26 Favored 'General case' 0 C--O 1.225 -0.196 0 CA-C-N 118.821 0.737 . . . . 0.0 110.489 177.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -54.46 -54.62 38.46 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 122.027 -0.421 . . . . 0.0 109.885 174.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 62.4 mt -61.12 -40.7 94.78 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.95 -44.48 67.66 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 110.386 -1.086 . . . . 0.0 110.386 -176.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.02 -44.3 93.0 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 117.942 0.871 . . . . 0.0 110.302 175.387 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 14.4 tp -50.94 -57.1 9.41 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 121.278 0.561 . . . . 0.0 109.659 173.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.36 -47.32 66.21 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.312 178.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 37.2 ttm -58.49 -46.64 86.25 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 123.963 0.905 . . . . 0.0 110.798 -179.105 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 63.6 mt -63.51 -62.99 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.162 0 CA-C-O 118.554 -0.736 . . . . 0.0 109.886 176.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.452 0.2 OUTLIER -68.16 -34.74 76.88 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 118.025 -1.47 . . . . 0.0 112.731 -169.868 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -83.91 66.84 9.34 Favored 'General case' 0 N--CA 1.462 0.149 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 167.628 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 82.9 mt-10 -41.78 -39.31 1.7 Allowed 'General case' 0 N--CA 1.463 0.209 0 C-N-CA 125.904 1.681 . . . . 0.0 112.028 -173.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.17 -50.94 0.31 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.848 1.659 . . . . 0.0 113.419 171.519 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 59.5 mt . . . . . 0 CA--C 1.533 0.326 0 C-N-CA 123.926 0.89 . . . . 0.0 113.32 -174.663 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.255 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 3.8 m -55.66 161.5 3.16 Favored Pre-proline 0 CA--C 1.54 0.559 0 C-N-CA 123.211 0.605 . . . . 0.0 110.797 174.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -44.26 -49.64 8.58 Favored 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 123.615 2.877 . . . . 0.0 113.285 178.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 6.1 mt -53.99 -47.82 71.02 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-O 119.643 -0.218 . . . . 0.0 111.466 174.158 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -64.93 -42.29 94.8 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 109.8 -0.445 . . . . 0.0 109.8 -174.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 tp60 -61.46 -46.69 89.01 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 122.179 0.192 . . . . 0.0 110.682 175.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.84 -46.88 83.06 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.411 0.685 . . . . 0.0 111.165 -178.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 57.8 mt -52.54 -51.99 29.95 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 C-N-CA 124.177 0.991 . . . . 0.0 108.448 169.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.68 -48.46 23.17 Favored Glycine 0 CA--C 1.528 0.874 0 C-N-CA 124.971 1.272 . . . . 0.0 111.654 175.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 mt -56.03 -54.51 44.03 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 117.492 0.646 . . . . 0.0 111.027 174.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 mp -57.94 -44.81 87.16 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.053 0.842 . . . . 0.0 111.666 -179.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 96.2 mt -56.32 -54.01 33.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 C-N-CA 123.171 0.588 . . . . 0.0 110.263 173.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.27 -50.19 57.01 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 110.293 -1.123 . . . . 0.0 110.293 -178.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 9.1 mm -53.85 -48.52 62.12 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 C-N-CA 123.684 0.794 . . . . 0.0 110.549 176.019 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -55.47 -62.28 1.78 Allowed 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.326 0.584 . . . . 0.0 109.686 176.571 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -52.7 -41.16 63.64 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.312 1.045 . . . . 0.0 111.427 -174.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -47.58 -39.96 17.97 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.713 1.205 . . . . 0.0 111.43 178.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -96.89 -62.48 1.25 Allowed 'General case' 0 C--O 1.233 0.199 0 N-CA-C 109.044 -0.725 . . . . 0.0 109.044 178.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.4 m . . . . . 0 C--O 1.232 0.172 0 C-N-CA 124.135 0.974 . . . . 0.0 111.975 -173.516 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 45.2 m80 . . . . . 0 CA--C 1.537 0.476 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -138.63 160.22 40.14 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 126.039 1.735 . . . . 0.0 107.412 176.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.53 176.87 11.12 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-O 118.998 -0.525 . . . . 0.0 110.938 176.369 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 39.1 p -125.71 174.0 8.62 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.701 0.682 . . . . 0.0 112.491 -174.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 11.3 ptpt -26.39 -56.65 0.08 Allowed 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 127.889 2.476 . . . . 0.0 113.981 170.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -53.78 -52.58 59.79 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 123.136 0.574 . . . . 0.0 110.551 -178.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 26.0 mp0 -67.8 -37.2 81.7 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 118.693 -0.67 . . . . 0.0 110.391 -178.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 62.3 mt -62.11 -51.96 65.8 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.266 0.939 . . . . 0.0 111.108 178.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -61.93 -42.13 98.75 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 122.987 0.515 . . . . 0.0 110.002 -179.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 58.9 mt-10 -54.87 -67.01 0.3 Allowed 'General case' 0 C--O 1.222 -0.353 0 CA-C-O 119.302 -0.38 . . . . 0.0 110.299 169.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 12.7 mt -37.61 -63.38 0.46 Allowed 'General case' 0 CA--C 1.52 -0.184 0 C-N-CA 125.98 1.712 . . . . 0.0 111.224 -179.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 13.6 tt -57.26 -54.38 31.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.158 -174.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 -73.7 -31.32 63.35 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.994 0.738 . . . . 0.0 112.994 -170.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.9 -56.98 4.2 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 176.336 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 68.9 mm-40 -77.06 -26.65 53.8 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 117.911 -1.042 . . . . 0.0 112.628 -168.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 95.5 mt . . . . . 0 C--N 1.339 0.11 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 167.538 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 . . . . . 0 C--O 1.225 -0.229 0 N-CA-C 114.111 1.152 . . . . 0.0 114.111 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -28.7 -60.13 0.13 Allowed 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 126.453 1.901 . . . . 0.0 113.561 -178.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -67.65 -39.81 84.56 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-O 120.889 0.376 . . . . 0.0 110.603 -172.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 53' ' ' ILE . . . . . 0.501 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.1 mp -62.05 -54.1 38.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 N-CA-C 106.931 -1.507 . . . . 0.0 106.931 179.213 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 70.9 t -58.71 -40.99 81.14 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 C-N-CA 124.452 1.101 . . . . 0.0 110.116 -177.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -58.19 -54.67 44.35 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 118.916 0.78 . . . . 0.0 110.307 172.198 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 36.7 mt -51.87 -41.87 62.21 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 119.231 -0.414 . . . . 0.0 111.606 178.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 24.0 mmt -69.56 -64.56 0.86 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 121.533 0.683 . . . . 0.0 109.988 177.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.65 -25.5 62.82 Favored 'General case' 0 N--CA 1.457 -0.088 0 C-N-CA 124.791 1.236 . . . . 0.0 112.293 -169.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -41.29 -50.09 3.69 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 124.273 1.029 . . . . 0.0 111.166 168.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 78.4 mt -59.08 -53.28 60.15 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -174.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -60.7 -44.03 97.07 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 124.582 1.153 . . . . 0.0 110.948 -179.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 29.4 ttm105 -59.05 -52.75 64.41 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.407 0.683 . . . . 0.0 110.108 178.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 . . . . . 0 N--CA 1.454 -0.232 0 CA-C-N 116.663 -0.244 . . . . 0.0 110.372 -171.778 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 . . . . . 0 CA--C 1.531 0.213 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 15.2 m -106.39 150.96 8.57 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 C-N-CA 124.697 1.199 . . . . 0.0 108.807 174.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -90.82 174.14 7.62 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.861 0.864 . . . . 0.0 110.826 173.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -39.06 -62.11 0.68 Allowed 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.019 1.328 . . . . 0.0 112.883 173.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 39.0 tp60 -61.84 -35.33 77.94 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 119.603 1.092 . . . . 0.0 111.605 -173.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -66.21 -43.42 86.77 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.667 -0.646 . . . . 0.0 110.139 176.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -54.67 -48.33 72.5 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.867 -0.52 . . . . 0.0 109.896 171.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 25.5 mm -58.55 -37.8 66.95 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 O-C-N 121.889 -0.507 . . . . 0.0 110.355 175.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 37.5 m -62.99 -42.86 99.96 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 121.521 -0.737 . . . . 0.0 110.203 175.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -56.14 -55.07 37.54 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 122.958 0.503 . . . . 0.0 110.017 176.046 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 39.6 mt -60.64 -44.28 96.58 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 122.188 -0.32 . . . . 0.0 111.861 177.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.56 -39.64 95.64 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 111.059 -0.816 . . . . 0.0 111.059 -175.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.32 -50.53 72.56 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 117.541 0.67 . . . . 0.0 109.425 173.118 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -49.39 -54.69 16.07 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 121.445 0.64 . . . . 0.0 109.894 174.658 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.08 -56.85 11.8 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 124.487 1.115 . . . . 0.0 110.716 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 11.4 ttp -60.74 -45.55 93.85 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.656 0.782 . . . . 0.0 111.315 -177.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 63.3 mt -61.97 -47.75 91.74 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-O 117.916 -1.04 . . . . 0.0 110.216 -175.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.453 0.0 OUTLIER -83.2 -31.58 27.0 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 179.89 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 32.0 m-80 -80.11 77.55 6.81 Favored 'General case' 0 N--CA 1.462 0.126 0 O-C-N 120.715 -1.241 . . . . 0.0 108.749 173.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 55.0 mm-40 -36.71 -43.29 0.41 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 126.024 1.729 . . . . 0.0 112.466 178.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -41.46 -41.19 1.99 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 126.185 1.794 . . . . 0.0 113.734 176.419 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 90.5 mt . . . . . 0 CA--C 1.531 0.23 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -177.278 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.196 0 CA-C-O 121.894 0.854 . . . . 0.0 109.706 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 13.6 m -60.01 160.87 14.2 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 125.93 1.692 . . . . 0.0 109.717 -177.659 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo -48.61 -49.41 14.79 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.977 2.451 . . . . 0.0 112.92 -176.779 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.6 mt -58.83 -41.25 86.45 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 173.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -63.04 -40.79 98.77 Favored 'General case' 0 C--O 1.225 -0.201 0 CA-C-N 118.979 0.809 . . . . 0.0 109.389 -178.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -60.24 -51.87 67.72 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 122.753 0.421 . . . . 0.0 110.427 174.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.56 -46.87 88.59 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 121.563 0.697 . . . . 0.0 111.639 -177.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 60.6 mt -55.23 -50.8 61.6 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 171.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -48.06 -46.96 26.79 Favored Glycine 0 CA--C 1.526 0.747 0 C-N-CA 125.157 1.361 . . . . 0.0 111.688 176.029 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.6 mt -54.85 -55.93 24.95 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.775 0.83 . . . . 0.0 110.916 173.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 11.0 mp -60.35 -43.87 96.08 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.546 -0.721 . . . . 0.0 111.914 -179.025 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 96.1 mt -55.34 -56.16 13.04 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.206 0 C-N-CA 123.226 0.611 . . . . 0.0 109.592 173.431 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -52.77 -49.72 52.78 Favored Glycine 0 CA--C 1.522 0.483 0 N-CA-C 110.356 -1.098 . . . . 0.0 110.356 -177.271 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 7.9 mm -53.4 -46.94 59.05 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 C-N-CA 122.694 0.398 . . . . 0.0 110.84 176.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 29.3 t80 -58.87 -60.35 3.98 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 121.939 0.876 . . . . 0.0 109.8 176.342 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.1 t-80 -55.41 -34.14 64.15 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 125.468 1.507 . . . . 0.0 111.871 -172.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 65.3 tttp -46.68 -36.69 7.37 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.586 1.154 . . . . 0.0 111.567 174.425 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -104.88 -62.61 1.32 Allowed 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 176.002 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.5 m . . . . . 0 C--O 1.226 -0.138 0 C-N-CA 124.74 1.216 . . . . 0.0 112.705 -171.911 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 36.4 p . . . . . 0 N--CA 1.466 0.369 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -145.65 -172.84 3.98 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.413 1.085 . . . . 0.0 108.92 169.42 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 96.5 p -147.21 -179.86 7.13 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.813 1.188 . . . . 0.0 113.188 -170.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -19.18 -71.3 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 128.922 2.889 . . . . 0.0 115.132 -178.287 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.1 ttpt -60.38 -44.76 95.34 Favored 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 121.88 -0.512 . . . . 0.0 109.879 -172.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -59.97 -40.98 90.95 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 123.199 0.6 . . . . 0.0 110.084 177.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 38.0 mt -65.2 -49.99 67.61 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 118.121 0.419 . . . . 0.0 111.365 178.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -57.6 -51.25 70.25 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 178.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 59.1 tt0 -48.4 -57.75 5.6 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.988 1.315 . . . . 0.0 109.751 173.462 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.3 mt -46.36 -72.94 0.05 OUTLIER 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 124.306 1.043 . . . . 0.0 110.247 176.017 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 18.8 tt -55.54 -42.53 68.75 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 CA-C-N 117.787 0.267 . . . . 0.0 110.533 -169.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -56.38 -51.37 68.58 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.83 -0.544 . . . . 0.0 111.618 174.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.29 -54.07 24.1 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 118.12 0.418 . . . . 0.0 110.596 -174.04 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.14 -9.12 43.61 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -169.771 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 23.1 mt . . . . . 0 N--CA 1.456 -0.158 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 170.801 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 . . . . . 0 N--CA 1.465 0.298 0 N-CA-C 115.523 1.675 . . . . 0.0 115.523 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -32.62 -62.01 0.25 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.535 1.534 . . . . 0.0 114.563 -174.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -65.23 -36.0 82.79 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-O 120.796 0.331 . . . . 0.0 111.093 -174.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.566 ' N ' HD12 ' A' ' 53' ' ' ILE . 1.3 mp -66.59 -52.75 42.55 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 N-CA-C 105.941 -1.874 . . . . 0.0 105.941 -176.267 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 86.4 t -53.38 -45.01 56.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 C-N-CA 124.173 0.989 . . . . 0.0 109.922 174.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.1 -50.39 73.65 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 118.92 0.782 . . . . 0.0 111.444 176.181 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 54.9 mt -56.06 -39.87 72.7 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 119.151 -0.452 . . . . 0.0 111.038 178.037 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 24.7 mmt -67.49 -60.35 2.64 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.808 0.731 . . . . 0.0 109.457 175.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -46.83 -40.17 13.31 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 126.89 2.076 . . . . 0.0 111.697 -176.23 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -38.78 -48.98 1.58 Allowed 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 124.908 1.283 . . . . 0.0 111.842 174.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 73.1 mt -58.45 -54.23 49.41 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.792 -0.448 . . . . 0.0 109.792 -176.31 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -66.01 -40.15 90.86 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 124.092 0.957 . . . . 0.0 111.275 -178.029 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 17.4 ttm180 . . . . . 0 N--CA 1.451 -0.375 0 C-N-CA 123.895 0.878 . . . . 0.0 109.585 178.254 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 . . . . . 0 N--CA 1.452 -0.327 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 11.0 m -80.37 139.79 17.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 -179.047 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -83.17 172.09 13.0 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 120.988 0.423 . . . . 0.0 111.232 176.385 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -41.61 -59.48 1.62 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.577 1.151 . . . . 0.0 111.827 173.08 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 36.0 tp60 -61.12 -38.87 87.89 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 119.11 0.868 . . . . 0.0 111.564 -175.6 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -60.94 -44.6 97.02 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.532 -0.73 . . . . 0.0 110.807 174.347 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -58.08 -47.62 82.65 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 121.699 -0.626 . . . . 0.0 109.961 174.115 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.7 mm -59.08 -33.51 50.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 O-C-N 121.704 -0.622 . . . . 0.0 110.174 175.315 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 41.8 m -69.24 -36.2 76.92 Favored 'General case' 0 C--O 1.224 -0.287 0 O-C-N 121.448 -0.782 . . . . 0.0 110.402 173.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -58.52 -56.88 16.4 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 173.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 33.1 mt -60.7 -45.2 95.09 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 122.451 0.3 . . . . 0.0 111.781 178.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.65 -43.97 95.64 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.742 -0.943 . . . . 0.0 110.742 -176.581 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.02 -45.48 81.36 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 121.961 -0.729 . . . . 0.0 110.139 176.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -48.73 -55.71 10.66 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.469 0.708 . . . . 0.0 109.872 171.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -53.37 -54.8 31.4 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 124.28 1.032 . . . . 0.0 111.092 178.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 21.7 ttp -63.02 -36.26 82.97 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 123.995 0.918 . . . . 0.0 111.774 -176.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 83.1 mt -64.31 -60.66 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 176.134 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.439 0.2 OUTLIER -67.79 -35.7 79.11 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 117.188 -1.805 . . . . 0.0 112.638 -173.374 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 44.6 m-80 -80.1 65.8 5.37 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 169.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -35.38 -46.94 0.4 Allowed 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 126.413 1.885 . . . . 0.0 111.968 -176.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -27.64 -58.25 0.11 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.711 2.004 . . . . 0.0 113.307 171.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.7 mt . . . . . 0 CA--C 1.533 0.323 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -172.243 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.216 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 46.1 p -69.66 166.7 28.85 Favored Pre-proline 0 N--CA 1.452 -0.366 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 171.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_exo -49.37 -44.95 32.43 Favored 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 122.438 2.092 . . . . 0.0 110.986 168.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.431 HD23 ' HA ' ' B' ' 5' ' ' LEU . 2.1 mt -56.28 -58.36 8.3 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 118.621 -0.704 . . . . 0.0 112.475 170.678 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -56.61 -38.8 72.56 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 119.162 0.892 . . . . 0.0 110.481 -174.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 -61.4 -51.47 68.61 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.952 0.901 . . . . 0.0 111.194 173.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.73 -46.2 90.66 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.631 0.729 . . . . 0.0 111.362 -178.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 82.4 mt -53.03 -52.1 32.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 C-N-CA 124.597 1.159 . . . . 0.0 108.048 169.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.53 -47.66 22.93 Favored Glycine 0 CA--C 1.527 0.818 0 C-N-CA 124.94 1.257 . . . . 0.0 111.903 174.211 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.6 mt -54.48 -56.47 18.42 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.719 0.808 . . . . 0.0 110.408 173.292 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -56.79 -43.31 80.77 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 118.663 0.665 . . . . 0.0 111.69 -179.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 99.3 mt -58.42 -54.41 33.26 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 C-N-CA 123.007 0.523 . . . . 0.0 110.681 173.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.76 -49.93 67.08 Favored Glycine 0 CA--C 1.522 0.519 0 N-CA-C 110.313 -1.115 . . . . 0.0 110.313 -177.156 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 8.1 mm -51.25 -51.66 22.23 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 C-N-CA 124.182 0.993 . . . . 0.0 109.843 173.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -54.17 -56.44 18.21 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 110.172 -0.306 . . . . 0.0 110.172 177.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -58.04 -38.15 75.7 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 123.754 0.821 . . . . 0.0 111.241 -175.236 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 64.2 tttm -50.37 -42.82 53.92 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.824 0.849 . . . . 0.0 111.118 179.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -98.32 -30.42 12.6 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 122.781 0.432 . . . . 0.0 112.029 -178.365 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 14.2 m . . . . . 0 C--O 1.226 -0.133 0 O-C-N 121.861 -0.524 . . . . 0.0 110.925 178.92 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 14.7 m80 . . . . . 0 CA--C 1.537 0.454 0 N-CA-C 110.232 -0.285 . . . . 0.0 110.232 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 53.8 p -134.06 166.97 21.49 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 125.298 1.439 . . . . 0.0 107.522 169.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -160.77 160.25 31.05 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 171.55 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -100.93 176.74 5.17 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.42 1.488 . . . . 0.0 113.009 -169.589 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -42.72 -52.17 5.04 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 126.533 1.933 . . . . 0.0 113.825 179.13 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -62.81 -47.63 82.62 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 -175.22 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -59.29 -40.56 86.57 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.701 0.8 . . . . 0.0 111.187 177.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 35.5 mt -64.44 -48.1 76.58 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 118.471 0.578 . . . . 0.0 111.311 175.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 9.0 mtmp? -57.86 -43.24 85.83 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.951 -0.468 . . . . 0.0 110.297 175.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -55.28 -57.91 9.88 Favored 'General case' 0 C--O 1.224 -0.245 0 CA-C-O 119.189 -0.434 . . . . 0.0 110.553 171.076 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 10.7 mt -44.22 -59.39 2.38 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 123.898 0.879 . . . . 0.0 110.242 -179.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 16.0 tt -64.64 -51.43 67.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 C-N-CA 119.683 -0.807 . . . . 0.0 110.297 -177.47 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.24 -32.59 74.24 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 120.959 -1.088 . . . . 0.0 112.887 -172.42 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.11 -58.5 2.54 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.194 0.998 . . . . 0.0 109.937 177.611 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 49.7 mm-40 -82.78 -24.79 33.27 Favored 'General case' 0 CA--C 1.529 0.171 0 O-C-N 121.449 -0.782 . . . . 0.0 112.966 -168.395 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 58.4 mt . . . . . 0 N--CA 1.46 0.065 0 C-N-CA 124.958 1.303 . . . . 0.0 108.02 169.593 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 . . . . . 0 CA--C 1.528 0.13 0 N-CA-C 114.777 1.399 . . . . 0.0 114.777 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.4 -60.08 0.15 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.682 1.593 . . . . 0.0 114.45 -176.225 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 62.3 tt0 -63.55 -44.06 95.26 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 122.756 0.422 . . . . 0.0 110.81 -176.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 53' ' ' ILE . . . . . 0.484 ' H ' ' CD1' ' B' ' 53' ' ' ILE . 1.2 mp -59.96 -50.06 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.459 0 N-CA-C 106.461 -1.681 . . . . 0.0 106.461 -176.708 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 75.0 t -55.96 -54.62 24.84 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.535 176.528 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.41 -51.04 28.56 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 118.555 0.616 . . . . 0.0 111.764 -179.641 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 27.7 mt -52.19 -40.86 62.11 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 122.703 0.401 . . . . 0.0 112.06 -178.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -81.06 -58.48 3.05 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.625 0.77 . . . . 0.0 110.582 179.751 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -40.98 -42.61 1.93 Allowed 'General case' 0 N--CA 1.462 0.133 0 C-N-CA 126.484 1.914 . . . . 0.0 111.418 177.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -38.41 -51.64 1.55 Allowed 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 125.123 1.369 . . . . 0.0 112.897 174.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -58.15 -50.54 73.15 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -174.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -64.49 -49.04 72.92 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.683 0.393 . . . . 0.0 110.445 179.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 13.7 ttm180 -50.99 -54.2 26.49 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 124.113 0.965 . . . . 0.0 110.073 -179.154 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 13.3 m120 . . . . . 0 N--CA 1.453 -0.319 0 CA-C-O 119.135 -0.46 . . . . 0.0 110.638 -179.513 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 . . . . . 0 N--CA 1.453 -0.291 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 19.7 m -79.06 145.8 8.91 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.225 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 -177.328 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -82.77 177.7 8.54 Favored 'General case' 0 CA--C 1.528 0.133 0 C-N-CA 123.925 0.89 . . . . 0.0 111.377 177.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -48.16 -63.31 1.11 Allowed 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 123.963 0.905 . . . . 0.0 112.209 178.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 43.2 tp60 -61.99 -34.18 75.69 Favored 'General case' 0 CA--C 1.531 0.245 0 O-C-N 121.138 -0.976 . . . . 0.0 111.13 -174.03 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 61.3 mt-10 -63.24 -45.54 91.11 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 121.569 -0.707 . . . . 0.0 110.75 174.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -54.61 -49.11 71.24 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 121.645 -0.659 . . . . 0.0 109.98 170.799 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 22.4 mm -57.94 -34.47 48.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 O-C-N 121.689 -0.632 . . . . 0.0 110.343 176.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 33.2 m -67.9 -39.74 83.57 Favored 'General case' 0 CA--C 1.53 0.206 0 O-C-N 121.343 -0.848 . . . . 0.0 110.541 175.425 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -53.8 -55.19 28.7 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.656 -0.652 . . . . 0.0 109.63 171.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 34.9 mt -60.16 -45.32 93.46 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.791 178.707 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.0 -42.25 98.29 Favored Glycine 0 CA--C 1.524 0.623 0 N-CA-C 110.787 -0.925 . . . . 0.0 110.787 -176.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.43 -50.17 68.59 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 123.273 0.629 . . . . 0.0 110.108 175.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -48.14 -56.66 7.3 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 121.775 0.798 . . . . 0.0 110.136 173.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.81 -54.1 39.01 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.015 1.326 . . . . 0.0 110.695 179.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 50.1 ttm -57.32 -48.67 78.37 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.232 1.013 . . . . 0.0 110.619 -179.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 61.9 mt -63.36 -51.43 71.01 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-O 117.585 -1.198 . . . . 0.0 109.653 -174.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.436 0.8 OUTLIER -73.58 -39.69 64.46 Favored 'General case' 0 C--N 1.347 0.482 0 C-N-CA 118.15 -1.42 . . . . 0.0 112.707 -179.561 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -80.59 63.09 4.9 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 169.06 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -51.33 -25.22 5.58 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.102 0.961 . . . . 0.0 113.058 -172.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -39.55 -50.51 2.2 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.832 1.253 . . . . 0.0 111.49 167.107 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 86.1 mt . . . . . 0 CA--C 1.53 0.211 0 C-N-CA 124.689 1.196 . . . . 0.0 113.535 -176.748 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.198 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 70.0 p -54.4 162.93 1.44 Allowed Pre-proline 0 CA--C 1.533 0.319 0 C-N-CA 124.348 1.059 . . . . 0.0 111.21 174.03 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -47.99 -46.59 21.55 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.356 2.038 . . . . 0.0 110.676 168.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.466 HD23 ' HA ' ' A' ' 5' ' ' LEU . 4.7 mt -55.11 -59.28 4.98 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-O 119.26 -0.4 . . . . 0.0 111.716 173.257 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -52.55 -48.14 66.32 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.13 0.423 . . . . 0.0 110.336 -176.021 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.85 -49.98 75.27 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.499 0.72 . . . . 0.0 110.258 -179.558 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.49 -45.69 91.87 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.949 0.9 . . . . 0.0 111.99 -177.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 84.8 mt -55.14 -50.92 59.91 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 N-CA-C 107.737 -1.209 . . . . 0.0 107.737 171.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -45.56 -49.14 11.92 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 124.505 1.05 . . . . 0.0 112.033 172.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.6 mt -56.88 -55.15 38.16 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.055 0.927 . . . . 0.0 111.303 175.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -59.85 -44.42 94.13 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 119.293 0.951 . . . . 0.0 111.505 -177.491 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 77.8 mt -56.45 -53.71 37.25 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 123.523 0.729 . . . . 0.0 109.948 173.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -53.81 -49.29 58.9 Favored Glycine 0 CA--C 1.522 0.47 0 C-N-CA 124.443 1.021 . . . . 0.0 110.572 -179.124 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 7.3 mm -57.76 -44.53 86.1 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 C-N-CA 122.986 0.514 . . . . 0.0 110.185 176.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 39.6 t80 -55.81 -54.89 39.0 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 118.797 0.726 . . . . 0.0 109.89 175.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 37.4 m-70 -64.9 -26.78 68.46 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 113.48 0.918 . . . . 0.0 113.48 -177.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.2 ttmm -52.82 -26.11 13.53 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 118.694 0.679 . . . . 0.0 110.751 170.403 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -127.51 41.7 3.46 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.715 1.206 . . . . 0.0 109.118 173.174 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 31.9 m . . . . . 0 C--N 1.348 0.512 0 C-N-CA 125.799 1.64 . . . . 0.0 112.408 -177.557 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 22.8 p . . . . . 0 CA--C 1.532 0.272 0 N-CA-C 113.256 0.835 . . . . 0.0 113.256 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -137.44 158.76 43.71 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.543 1.137 . . . . 0.0 110.77 176.824 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 88.8 p -117.71 -173.91 2.52 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.395 1.078 . . . . 0.0 112.8 -169.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 49.4 pttt -41.47 -54.53 3.09 Favored 'General case' 0 C--N 1.34 0.194 0 C-N-CA 126.144 1.778 . . . . 0.0 113.77 -177.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.84 -52.83 59.16 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 124.66 1.184 . . . . 0.0 108.457 -177.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -64.33 -38.59 91.57 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 123.723 0.809 . . . . 0.0 110.689 -177.441 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.4 HD12 ' CE2' ' A' ' 76' ' ' PHE . 2.7 mm? -60.95 -54.91 39.22 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 118.869 0.758 . . . . 0.0 111.299 175.245 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 53.4 mtmt -56.54 -48.53 77.06 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.067 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 62.9 tt0 -50.46 -59.0 4.45 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.174 0.989 . . . . 0.0 110.427 175.206 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mt -47.1 -65.87 0.5 Allowed 'General case' 0 C--O 1.232 0.165 0 C-N-CA 124.968 1.307 . . . . 0.0 110.411 177.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 16.7 tt -62.42 -45.7 98.17 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 C-N-CA 120.04 -0.664 . . . . 0.0 109.77 -170.458 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -58.72 -51.79 68.46 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 122.836 0.454 . . . . 0.0 111.404 -179.268 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -66.26 -57.66 7.06 Favored 'General case' 0 C--N 1.339 0.11 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 -177.517 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -71.96 -61.63 1.72 Allowed 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 -169.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 54.7 mt . . . . . 0 N--CA 1.451 -0.382 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.447 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 . . . . . 0 C--O 1.226 -0.14 0 N-CA-C 110.405 -0.22 . . . . 0.0 110.405 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -38.03 -58.18 0.97 Allowed 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.648 1.179 . . . . 0.0 113.548 -171.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -64.21 -38.36 90.78 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 122.751 0.42 . . . . 0.0 111.196 -175.071 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.556 ' CD1' ' H ' ' A' ' 53' ' ' ILE . 0.8 OUTLIER -62.13 -54.12 38.61 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 N-CA-C 106.397 -1.705 . . . . 0.0 106.397 179.206 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 87.5 t -57.4 -42.09 79.88 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 C-N-CA 124.173 0.989 . . . . 0.0 110.566 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.05 -50.59 73.13 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 119.384 0.993 . . . . 0.0 110.886 175.13 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 42.1 mt -54.21 -45.19 72.18 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 119.396 -0.335 . . . . 0.0 110.681 177.168 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 23.2 mmt -64.94 -60.69 2.77 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 121.403 0.621 . . . . 0.0 109.499 177.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -42.7 -42.93 3.68 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 126.815 2.046 . . . . 0.0 111.521 -178.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -45.7 -45.37 14.22 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 118.517 -0.754 . . . . 0.0 112.97 178.19 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . 0.259 0.5 OUTLIER -72.04 -11.49 60.78 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 119.805 1.184 . . . . 0.0 113.209 -176.838 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -90.68 -53.89 4.22 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 118.983 0.81 . . . . 0.0 109.206 169.774 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 55.3 ttm-85 . . . . . 0 CA--C 1.532 0.276 0 C-N-CA 123.986 0.914 . . . . 0.0 110.693 179.552 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.9 mp0 . . . . . 0 N--CA 1.448 -0.56 0 N-CA-C 106.241 -1.763 . . . . 0.0 106.241 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -96.96 151.16 4.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 C-N-CA 124.266 1.026 . . . . 0.0 108.467 172.442 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -92.94 177.12 6.18 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 122.834 0.454 . . . . 0.0 111.287 176.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 79.6 t80 -41.14 -62.43 0.84 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.315 1.046 . . . . 0.0 112.034 171.32 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 39.8 tp60 -60.64 -37.42 81.43 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 119.24 0.927 . . . . 0.0 111.623 -174.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -61.47 -44.68 96.67 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 119.28 0.946 . . . . 0.0 111.424 173.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -53.94 -50.03 67.38 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 118.742 0.701 . . . . 0.0 109.726 172.581 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.401 ' CG2' ' CG2' ' B' ' 74' ' ' ILE . 28.1 mm -57.96 -38.27 65.7 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 O-C-N 121.901 -0.499 . . . . 0.0 110.518 176.024 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 61.3 m -64.88 -42.39 94.85 Favored 'General case' 0 C--O 1.226 -0.134 0 CA-C-N 118.824 0.738 . . . . 0.0 110.234 177.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.4 ' CE2' HD12 ' A' ' 34' ' ' LEU . 33.0 t80 -55.55 -52.69 62.88 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.429 0.691 . . . . 0.0 109.213 174.863 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 62.3 mt -60.66 -44.69 96.14 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 177.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.13 -44.41 94.12 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 110.623 -0.991 . . . . 0.0 110.623 -176.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.85 -52.13 66.74 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.252 0.621 . . . . 0.0 109.824 174.718 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 11.7 tp -47.78 -58.15 4.7 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 122.002 0.906 . . . . 0.0 110.381 175.228 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -49.67 -55.47 13.65 Favored 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 125.43 1.492 . . . . 0.0 109.857 -179.327 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 12.9 ttp -60.53 -44.31 96.19 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 123.364 0.666 . . . . 0.0 111.507 -178.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 51.7 mt -59.19 -54.61 31.9 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-O 118.258 -0.877 . . . . 0.0 110.049 -178.36 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.391 0.6 OUTLIER -76.0 -34.22 59.71 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 118.188 -1.405 . . . . 0.0 112.964 -179.08 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 37.0 m-80 -80.33 71.06 7.11 Favored 'General case' 0 N--CA 1.465 0.276 0 O-C-N 120.654 -1.279 . . . . 0.0 108.747 170.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -46.55 -31.5 2.82 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.554 1.142 . . . . 0.0 112.798 -178.124 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -42.47 -37.75 1.71 Allowed 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.044 1.338 . . . . 0.0 113.729 173.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 88.4 mt . . . . . 0 CA--C 1.534 0.328 0 N-CA-C 112.949 0.722 . . . . 0.0 112.949 -177.61 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.454 -0.249 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 9.6 m -54.14 160.57 2.31 Favored Pre-proline 0 CA--C 1.538 0.509 0 C-N-CA 123.309 0.643 . . . . 0.0 110.851 175.172 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_exo -42.16 -49.56 5.86 Favored 'Trans proline' 0 N--CA 1.459 -0.52 0 C-N-CA 123.775 2.983 . . . . 0.0 113.661 177.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 6.1 mt -54.52 -50.52 67.67 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-N 117.956 0.344 . . . . 0.0 111.54 173.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -63.49 -40.9 98.31 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 118.211 0.459 . . . . 0.0 110.196 -175.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 tp60 -61.89 -47.07 86.64 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 122.142 0.177 . . . . 0.0 110.694 174.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.05 -46.88 85.45 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.465 0.706 . . . . 0.0 111.02 -178.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 62.1 mt -51.4 -54.4 11.91 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 N-CA-C 107.948 -1.131 . . . . 0.0 107.948 169.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.07 -46.88 20.57 Favored Glycine 0 CA--C 1.528 0.859 0 C-N-CA 124.906 1.241 . . . . 0.0 112.183 175.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.2 mt -57.38 -54.21 49.37 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 117.59 0.695 . . . . 0.0 111.055 174.489 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -58.52 -44.07 89.37 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 118.863 0.756 . . . . 0.0 111.481 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 72.2 mt -54.38 -55.73 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 C-N-CA 123.462 0.705 . . . . 0.0 110.077 172.496 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.28 -51.38 51.36 Favored Glycine 0 CA--C 1.524 0.633 0 N-CA-C 110.234 -1.146 . . . . 0.0 110.234 -176.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 14.1 mm -54.5 -45.83 70.84 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 C-N-CA 122.79 0.436 . . . . 0.0 110.499 175.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -57.12 -60.19 3.98 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 118.465 0.575 . . . . 0.0 109.997 176.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -55.34 -36.46 66.31 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 124.424 1.09 . . . . 0.0 111.511 -174.181 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -52.59 -31.06 34.4 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.566 1.146 . . . . 0.0 112.257 176.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -112.59 -34.08 5.94 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.764 0.711 . . . . 0.0 112.076 -179.315 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 77.8 p . . . . . 0 N--CA 1.455 -0.182 0 CA-C-N 119.135 0.88 . . . . 0.0 110.866 179.582 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 . . . . . 0 CA--C 1.537 0.457 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 22.9 p -129.87 164.25 24.56 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 124.836 1.255 . . . . 0.0 111.419 -177.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -159.56 169.07 24.62 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.626 1.17 . . . . 0.0 109.364 169.716 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 78.5 p -115.94 174.16 6.18 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 -169.382 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 38.1 mtmm -26.35 -60.3 0.08 Allowed 'General case' 0 C--N 1.34 0.171 0 C-N-CA 127.764 2.426 . . . . 0.0 112.597 169.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 28.8 ttpp -53.37 -53.23 54.18 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.885 0.874 . . . . 0.0 110.748 -177.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -61.36 -40.44 94.31 Favored 'General case' 0 C--O 1.222 -0.344 0 CA-C-O 118.967 -0.54 . . . . 0.0 110.595 179.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 31.1 mt -64.49 -48.05 76.65 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.934 0.788 . . . . 0.0 111.179 -179.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -58.12 -47.93 81.77 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 176.028 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.63 -51.14 69.85 Favored 'General case' 0 C--O 1.225 -0.216 0 CA-C-N 117.762 0.255 . . . . 0.0 111.242 174.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 11.5 mt -48.18 -57.51 5.8 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 124.25 1.02 . . . . 0.0 109.77 179.07 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 1.3 mp -56.84 -59.1 3.42 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 C-N-CA 120.18 -0.608 . . . . 0.0 109.831 175.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -51.33 -46.8 62.75 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.358 0.663 . . . . 0.0 112.372 -171.183 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.71 -64.54 1.16 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.709 0.804 . . . . 0.0 110.08 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -73.87 -24.84 59.8 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -167.177 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 96.3 mt . . . . . 0 C--N 1.333 -0.12 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 169.287 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 21.0 t70 . . . . . 0 N--CA 1.462 0.172 0 N-CA-C 111.927 0.343 . . . . 0.0 111.927 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -34.77 -60.99 0.42 Allowed 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.905 1.282 . . . . 0.0 113.72 -176.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -66.23 -33.97 76.96 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.588 0.355 . . . . 0.0 111.365 -174.469 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 53' ' ' ILE . . . . . 0.463 ' H ' ' CD1' ' B' ' 53' ' ' ILE . 1.0 OUTLIER -62.89 -55.73 21.87 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 178.665 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 55.8 t -57.66 -43.82 84.3 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 CA-C-O 118.755 -0.64 . . . . 0.0 110.599 179.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.48 -51.06 69.87 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 119.233 0.924 . . . . 0.0 110.562 176.492 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 55.2 mt -56.63 -40.58 75.63 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 119.058 -0.496 . . . . 0.0 111.405 178.751 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 28.3 mmt -67.25 -65.04 0.74 Allowed 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.919 0.781 . . . . 0.0 109.453 175.531 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -40.58 -41.93 1.57 Allowed 'General case' 0 CA--C 1.521 -0.155 0 C-N-CA 128.022 2.529 . . . . 0.0 111.939 -177.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -37.73 -49.17 1.13 Allowed 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 124.93 1.292 . . . . 0.0 112.287 176.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.6 pp -61.18 -42.91 99.41 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 120.958 -0.297 . . . . 0.0 111.085 -176.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -73.98 -38.3 64.19 Favored 'General case' 0 C--O 1.226 -0.173 0 C-N-CA 123.155 0.582 . . . . 0.0 110.407 -179.175 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 15.8 ttm180 -59.46 -47.98 83.39 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.164 0.586 . . . . 0.0 109.951 177.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 . . . . . 0 N--CA 1.457 -0.094 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.264 -175.52 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 40.6 mp0 . . . . . 0 N--CA 1.451 -0.388 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 11.7 m -80.07 145.25 9.46 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 171.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -82.89 172.21 13.06 Favored 'General case' 0 CA--C 1.528 0.107 0 CA-C-N 117.961 0.346 . . . . 0.0 111.193 176.282 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -40.86 -61.61 0.94 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.185 0.994 . . . . 0.0 112.146 172.161 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 38.2 tp60 -60.33 -37.04 79.36 Favored 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.224 -0.922 . . . . 0.0 111.795 -175.692 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -64.93 -40.82 95.62 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 121.284 -0.885 . . . . 0.0 111.488 174.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -56.43 -49.72 73.74 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.571 -0.706 . . . . 0.0 109.622 170.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 0.401 ' CG2' ' CG2' ' A' ' 74' ' ' ILE . 29.0 mm -56.24 -39.56 60.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 175.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 43.1 m -65.69 -35.74 81.63 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 118.59 0.632 . . . . 0.0 110.679 176.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 13.1 t80 -56.02 -56.25 23.06 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 171.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 67.7 mt -61.25 -40.13 92.91 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 179.089 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -69.05 -45.6 61.92 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 110.675 -0.97 . . . . 0.0 110.675 -176.134 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.29 -43.82 89.92 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 122.112 -0.64 . . . . 0.0 110.058 175.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 12.0 tp -50.56 -57.58 7.82 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-O 121.371 0.605 . . . . 0.0 109.939 172.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.19 -50.86 48.04 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 124.441 1.096 . . . . 0.0 110.527 176.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 49.2 ttm -58.33 -47.75 82.74 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.715 0.806 . . . . 0.0 111.135 -178.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 93.9 mt -64.65 -52.72 51.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 CA-C-O 118.135 -0.936 . . . . 0.0 110.398 -176.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.449 0.1 OUTLIER -76.2 -38.86 55.96 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 118.521 -1.271 . . . . 0.0 113.3 -176.672 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -82.13 66.99 7.96 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 169.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -39.44 -37.8 0.5 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.818 1.647 . . . . 0.0 113.842 -175.188 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.99 -53.98 0.47 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.004 1.722 . . . . 0.0 112.502 169.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 93.2 mt . . . . . 0 C--O 1.224 -0.267 0 C-N-CA 123.81 0.844 . . . . 0.0 113.081 -174.039 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.257 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.1 m -55.56 163.09 2.04 Favored Pre-proline 0 CA--C 1.537 0.452 0 C-N-CA 124.102 0.961 . . . . 0.0 110.846 178.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -43.85 -49.02 8.57 Favored 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 123.62 2.88 . . . . 0.0 113.409 179.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.2 mt -55.14 -52.13 64.25 Favored 'General case' 0 C--O 1.225 -0.218 0 O-C-N 122.369 -0.207 . . . . 0.0 111.512 174.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -61.56 -41.98 98.18 Favored 'General case' 0 C--O 1.226 -0.181 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 -175.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 12.6 tp-100 -60.31 -51.25 70.33 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 123.4 0.68 . . . . 0.0 110.203 177.157 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.14 -46.15 88.58 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.291 0.636 . . . . 0.0 111.442 -177.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 56.4 mt -53.07 -51.43 38.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 170.4 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -48.61 -48.03 29.18 Favored Glycine 0 CA--C 1.525 0.688 0 C-N-CA 125.14 1.352 . . . . 0.0 111.587 175.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 mt -56.54 -54.03 50.6 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 117.652 0.726 . . . . 0.0 111.055 174.258 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 mp -58.81 -43.71 90.64 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 119.032 0.833 . . . . 0.0 111.453 -179.404 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 94.2 mt -56.52 -51.66 62.58 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 C-N-CA 123.632 0.773 . . . . 0.0 110.36 172.641 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.23 -51.58 53.19 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.046 -1.222 . . . . 0.0 110.046 -178.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 10.4 mm -57.01 -46.29 84.08 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 123.158 0.583 . . . . 0.0 110.284 176.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 40.6 t80 -53.2 -59.16 4.9 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 121.211 0.529 . . . . 0.0 109.965 176.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 67.4 t60 -62.09 -33.75 75.02 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.706 -175.682 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -51.96 -45.61 64.46 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.69 0.677 . . . . 0.0 110.963 176.38 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -89.86 -49.55 6.56 Favored 'General case' 0 N--CA 1.46 0.037 0 CA-C-O 118.932 -0.556 . . . . 0.0 110.946 -178.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 74.8 m . . . . . 0 C--O 1.224 -0.248 0 CA-C-N 119.166 0.894 . . . . 0.0 111.384 174.652 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.454 -0.228 0 N-CA-C 103.192 -2.892 . . . . 0.0 103.192 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -160.74 168.04 25.62 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 120.158 1.345 . . . . 0.0 112.253 177.555 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 24.7 p -113.19 176.46 5.01 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.617 0.723 . . . . 0.0 112.503 -173.42 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 20.7 pttm -40.62 -46.94 2.66 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 126.051 1.74 . . . . 0.0 112.846 174.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.0 tmmt? -59.08 -49.7 76.89 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -178.083 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 27.2 mp0 -62.98 -38.62 91.88 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 118.756 -0.64 . . . . 0.0 110.963 177.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 26.1 mt -62.43 -45.01 95.05 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 119.319 0.963 . . . . 0.0 111.182 178.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -58.3 -49.47 77.03 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 122.025 -0.422 . . . . 0.0 109.978 173.203 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 57.6 mt-10 -56.47 -43.82 79.97 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 118.03 0.377 . . . . 0.0 111.449 175.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.0 mt -54.32 -56.3 19.84 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 119.296 0.953 . . . . 0.0 109.492 -178.432 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 1.3 mp -55.96 -60.7 1.55 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 175.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.8 tt0 -52.31 -51.42 58.74 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.649 0.78 . . . . 0.0 112.383 -171.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.1 mmpt? -73.4 -61.12 1.94 Allowed 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.987 1.315 . . . . 0.0 109.307 -175.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 60.5 mm-40 -76.71 -58.01 3.53 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -169.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 85.1 mt . . . . . 0 N--CA 1.454 -0.264 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 178.868 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 . . . . . 0 N--CA 1.462 0.153 0 N-CA-C 114.513 1.301 . . . . 0.0 114.513 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.46 -58.27 0.16 Allowed 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 126.08 1.752 . . . . 0.0 113.839 -177.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -70.08 -35.88 74.51 Favored 'General case' 0 CA--C 1.53 0.191 0 O-C-N 122.258 -0.276 . . . . 0.0 111.466 -173.23 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.491 HD12 ' H ' ' A' ' 53' ' ' ILE . 1.2 mp -62.72 -54.71 30.27 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 177.064 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 72.5 t -54.21 -44.45 64.67 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 C-N-CA 124.458 1.103 . . . . 0.0 110.034 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 2.9 mptp? -57.52 -53.17 61.23 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 118.283 0.492 . . . . 0.0 110.793 175.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 71.2 mt -54.83 -37.81 66.61 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 118.965 -0.54 . . . . 0.0 111.198 178.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 27.8 mmt -66.95 -67.61 0.44 Allowed 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 118.809 0.732 . . . . 0.0 109.525 173.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -40.48 -42.62 1.66 Allowed 'General case' 0 C--N 1.341 0.199 0 C-N-CA 127.527 2.331 . . . . 0.0 111.95 -176.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -38.7 -49.64 1.59 Allowed 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 125.261 1.424 . . . . 0.0 112.492 177.095 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -63.24 -42.0 99.14 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 121.032 -0.267 . . . . 0.0 110.715 -176.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -69.52 -42.17 75.04 Favored 'General case' 0 N--CA 1.457 -0.084 0 C-N-CA 123.538 0.735 . . . . 0.0 109.602 -178.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 17.5 ttm180 . . . . . 0 N--CA 1.451 -0.405 0 C-N-CA 124.25 1.02 . . . . 0.0 110.143 178.647 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 22.5 mp0 . . . . . 0 CA--C 1.534 0.331 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 25.8 m -115.05 149.11 17.36 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.558 0 C-N-CA 125.917 1.687 . . . . 0.0 107.758 169.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -85.8 175.57 8.6 Favored 'General case' 0 C--N 1.338 0.102 0 C-N-CA 123.68 0.792 . . . . 0.0 111.015 177.454 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -41.91 -63.8 0.68 Allowed 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.806 1.242 . . . . 0.0 112.436 175.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 9.9 tp-100 -64.5 -30.45 71.48 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 120.339 1.427 . . . . 0.0 112.019 -173.276 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -66.84 -45.53 77.94 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 119.35 0.977 . . . . 0.0 110.348 175.17 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -54.72 -52.27 62.99 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 172.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 22.8 mm -55.32 -41.41 61.58 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.411 0 C-N-CA 123.102 0.561 . . . . 0.0 109.519 176.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 99.4 m -62.39 -36.04 81.08 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-N 119.089 0.859 . . . . 0.0 111.062 177.088 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -54.89 -54.57 40.8 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 118.887 0.767 . . . . 0.0 109.185 171.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 62.3 mt -63.63 -40.86 97.97 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 -179.506 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -72.83 -44.29 38.58 Favored Glycine 0 CA--C 1.522 0.522 0 N-CA-C 110.128 -1.189 . . . . 0.0 110.128 -174.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.43 -45.11 92.44 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 121.949 -0.736 . . . . 0.0 109.795 173.255 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 12.4 tp -49.81 -58.14 5.96 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 118.802 0.728 . . . . 0.0 109.909 173.133 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -49.34 -54.03 19.19 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 124.804 1.242 . . . . 0.0 110.606 178.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 25.4 ttp -64.11 -41.54 97.21 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.252 0.621 . . . . 0.0 112.068 -176.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 80.0 mt -65.12 -51.56 64.29 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 CA-C-O 118.042 -0.98 . . . . 0.0 109.746 -178.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.46 0.1 OUTLIER -75.76 -39.3 57.34 Favored 'General case' 0 C--N 1.346 0.436 0 CA-C-N 119.713 1.142 . . . . 0.0 113.283 -178.544 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 -81.07 65.01 6.05 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 168.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -47.91 -32.86 6.8 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.94 1.296 . . . . 0.0 112.4 -169.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -32.54 -50.55 0.25 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 126.104 1.762 . . . . 0.0 112.773 168.355 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 63.2 mt . . . . . 0 CA--C 1.53 0.21 0 C-N-CA 124.015 0.926 . . . . 0.0 113.322 -174.864 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.242 0 CA-C-O 121.191 0.519 . . . . 0.0 110.053 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 4.2 m -58.1 165.17 2.84 Favored Pre-proline 0 CA--C 1.538 0.513 0 C-N-CA 124.961 1.305 . . . . 0.0 111.365 179.193 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -44.47 -46.77 11.71 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 123.503 2.802 . . . . 0.0 113.306 177.834 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.426 HD23 ' HA ' ' B' ' 5' ' ' LEU . 5.7 mt -56.16 -51.48 67.82 Favored 'General case' 0 C--O 1.225 -0.229 0 CA-C-N 117.844 0.293 . . . . 0.0 111.577 174.123 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -57.83 -45.57 85.97 Favored 'General case' 0 N--CA 1.456 -0.159 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 -177.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -58.73 -51.57 69.41 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 122.932 0.493 . . . . 0.0 110.727 177.38 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.32 -45.41 88.0 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.719 0.807 . . . . 0.0 111.668 -176.158 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 78.7 mt -54.13 -52.38 38.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 170.475 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.15 -48.36 15.08 Favored Glycine 0 CA--C 1.528 0.855 0 C-N-CA 124.867 1.222 . . . . 0.0 111.946 174.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.3 mt -56.88 -55.85 29.15 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 117.649 0.725 . . . . 0.0 111.27 174.407 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -58.69 -42.38 88.42 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.172 0.897 . . . . 0.0 111.711 -178.445 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 78.7 mt -54.63 -58.97 2.64 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.135 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 171.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -52.29 -48.03 54.69 Favored Glycine 0 CA--C 1.524 0.604 0 C-N-CA 124.726 1.155 . . . . 0.0 111.214 -175.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 12.5 mm -54.63 -46.58 72.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 C-N-CA 123.105 0.562 . . . . 0.0 110.386 176.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 26.2 t80 -61.05 -54.27 46.88 Favored 'General case' 0 CA--C 1.531 0.241 0 O-C-N 121.708 -0.62 . . . . 0.0 109.818 176.1 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -50.74 -41.72 56.81 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 125.308 1.443 . . . . 0.0 111.435 -176.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -55.58 -34.01 64.41 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.934 1.293 . . . . 0.0 112.407 179.312 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 47.1 m-85 -109.06 -57.45 2.15 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 123.587 0.755 . . . . 0.0 110.896 -176.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.454 -0.237 0 C-N-CA 123.504 0.722 . . . . 0.0 110.244 -177.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 21.9 t-160 . . . . . 0 CA--C 1.535 0.387 0 N-CA-C 111.552 0.204 . . . . 0.0 111.552 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 1.1 p -130.57 158.68 39.33 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 125.107 1.363 . . . . 0.0 112.606 -168.452 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.94 -179.79 7.84 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.055 1.342 . . . . 0.0 108.553 169.423 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 7.3 t -141.6 -163.21 1.52 Allowed 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 119.355 0.98 . . . . 0.0 112.673 -178.127 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 8.6 mtpm? -36.79 -69.12 0.12 Allowed 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 128.716 2.806 . . . . 0.0 113.662 -169.189 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -55.38 -46.97 76.5 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 122.772 0.429 . . . . 0.0 110.068 -173.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -61.32 -44.12 97.74 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 123.797 0.839 . . . . 0.0 110.712 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 51.7 mt -61.31 -52.98 62.43 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 118.341 0.519 . . . . 0.0 111.015 177.072 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 47.9 mtpt -60.92 -42.61 98.46 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -177.786 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 66.4 mt-10 -54.61 -55.58 28.02 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-O 118.962 -0.542 . . . . 0.0 110.904 169.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 9.1 mt -47.36 -58.89 3.63 Favored 'General case' 0 N--CA 1.457 -0.103 0 C-N-CA 123.406 0.682 . . . . 0.0 110.193 -178.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 13.3 tt -59.34 -55.18 25.39 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 C-N-CA 119.766 -0.774 . . . . 0.0 110.54 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -58.41 -46.05 87.18 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 118.435 0.562 . . . . 0.0 112.438 -172.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -76.76 -51.08 12.07 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.509 0.724 . . . . 0.0 110.093 -177.263 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -83.54 -28.7 28.43 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -168.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 32.7 mt . . . . . 0 C--N 1.338 0.069 0 N-CA-C 106.412 -1.699 . . . . 0.0 106.412 168.483 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 . . . . . 0 C--O 1.227 -0.113 0 N-CA-C 114.397 1.258 . . . . 0.0 114.397 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.58 -61.57 0.14 Allowed 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 125.594 1.558 . . . . 0.0 114.146 -175.217 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -60.31 -43.15 96.62 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.298 0.639 . . . . 0.0 111.333 -175.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 53' ' ' ILE . . . . . 0.526 ' H ' ' CD1' ' B' ' 53' ' ' ILE . 1.0 OUTLIER -62.16 -51.99 65.79 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 N-CA-C 106.066 -1.827 . . . . 0.0 106.066 -178.785 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 70.7 t -55.3 -40.02 54.74 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.613 0 CA-C-N 114.891 -1.05 . . . . 0.0 110.239 178.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.84 -52.81 63.48 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 120.214 1.37 . . . . 0.0 110.517 174.741 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 57.1 mt -53.52 -39.57 64.74 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 119.573 -0.251 . . . . 0.0 110.683 -178.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 22.9 mmt -71.12 -64.23 0.95 Allowed 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.424 0.63 . . . . 0.0 110.003 175.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.01 -29.4 60.29 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 125.041 1.336 . . . . 0.0 112.212 -169.718 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -39.52 -50.69 2.19 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 124.632 1.173 . . . . 0.0 111.037 170.584 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 54.1 mt -58.82 -47.08 86.07 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.125 -176.421 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -69.73 -46.43 65.93 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.439 0.696 . . . . 0.0 111.283 -178.128 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 50.9 ttt85 -56.84 -52.22 65.94 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 124.972 1.309 . . . . 0.0 109.414 -179.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 20.3 m120 . . . . . 0 N--CA 1.452 -0.371 0 CA-C-N 116.625 -0.261 . . . . 0.0 111.556 -176.121 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 . . . . . 0 N--CA 1.45 -0.433 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 20.9 m -99.89 146.49 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 169.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -85.36 176.02 8.54 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 123.418 0.687 . . . . 0.0 111.271 175.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -40.65 -63.82 0.6 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.306 1.043 . . . . 0.0 112.533 172.421 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 61.6 tp60 -61.03 -36.21 78.92 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 119.755 1.161 . . . . 0.0 111.671 -175.425 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -64.37 -35.84 82.18 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.255 -0.903 . . . . 0.0 111.081 175.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -62.97 -46.8 86.02 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.507 -0.746 . . . . 0.0 109.626 169.361 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 24.2 mm -60.63 -29.19 44.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 O-C-N 121.49 -0.756 . . . . 0.0 110.513 176.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 25.3 m -67.2 -45.13 77.8 Favored 'General case' 0 C--O 1.227 -0.1 0 O-C-N 121.232 -0.917 . . . . 0.0 109.411 171.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -52.32 -54.99 24.51 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 173.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 38.8 mt -59.44 -46.36 88.98 Favored 'General case' 0 CA--C 1.529 0.168 0 O-C-N 121.727 -0.608 . . . . 0.0 111.691 177.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.57 -45.68 92.91 Favored Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 -179.261 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.97 -51.74 65.71 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 123.493 0.717 . . . . 0.0 110.023 177.281 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -47.36 -58.68 3.87 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.95 0.881 . . . . 0.0 110.272 174.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.08 -56.61 11.73 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 125.18 1.392 . . . . 0.0 110.643 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 12.8 ttp -67.05 -39.15 86.84 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.607 0.763 . . . . 0.0 111.806 -174.372 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 64.5 mt -63.74 -51.76 65.75 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 CA-C-O 117.807 -1.092 . . . . 0.0 109.195 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.474 0.3 OUTLIER -75.25 -38.15 60.67 Favored 'General case' 0 C--N 1.348 0.5 0 CA-C-N 119.897 1.226 . . . . 0.0 113.319 -179.867 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 -80.57 61.88 4.44 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 168.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -52.26 -25.01 8.31 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.532 1.133 . . . . 0.0 112.55 -175.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -38.6 -46.72 1.23 Allowed 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.164 1.385 . . . . 0.0 111.845 167.366 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 84.4 mt . . . . . 0 CA--C 1.532 0.252 0 C-N-CA 124.12 0.968 . . . . 0.0 113.041 -178.218 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.222 0 CA-C-O 121.252 0.548 . . . . 0.0 111.431 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 78.7 p -60.69 167.4 3.4 Favored Pre-proline 0 CA--C 1.536 0.418 0 C-N-CA 124.414 1.086 . . . . 0.0 112.2 175.479 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -50.57 -44.3 40.84 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 122.619 2.213 . . . . 0.0 111.215 168.245 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.415 HD23 ' HA ' ' A' ' 5' ' ' LEU . 4.8 mt -53.65 -57.49 10.61 Favored 'General case' 0 C--N 1.342 0.252 0 CA-C-O 119.448 -0.31 . . . . 0.0 111.671 170.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -52.57 -47.65 66.68 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 120.848 0.356 . . . . 0.0 110.356 -177.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 -59.39 -49.41 77.92 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.921 0.888 . . . . 0.0 110.919 178.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.77 -46.63 88.74 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.866 0.866 . . . . 0.0 111.132 -178.084 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 83.1 mt -54.67 -51.41 51.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 172.057 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.72 -50.35 14.78 Favored Glycine 0 CA--C 1.53 0.991 0 C-N-CA 124.562 1.077 . . . . 0.0 111.963 173.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 mt -54.65 -54.37 42.52 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 117.721 0.761 . . . . 0.0 110.936 175.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 9.8 mp -58.71 -43.68 90.17 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 118.79 0.723 . . . . 0.0 111.687 -178.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 97.3 mt -58.59 -52.18 62.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 C-N-CA 123.22 0.608 . . . . 0.0 110.433 174.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.96 -54.55 34.51 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 109.942 -1.263 . . . . 0.0 109.942 -178.325 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 6.0 mm -50.01 -50.11 20.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.25 0 C-N-CA 123.843 0.857 . . . . 0.0 109.911 174.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -52.89 -62.71 1.47 Allowed 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 179.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -63.38 -23.57 67.47 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 -175.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.8 ttpp -53.94 -24.69 17.28 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 118.782 0.719 . . . . 0.0 111.97 170.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -116.95 -37.34 3.61 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.044 0.938 . . . . 0.0 112.792 175.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 75.5 p . . . . . 0 CA--C 1.528 0.125 0 CA-C-N 119.515 1.052 . . . . 0.0 112.164 -178.169 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 74.6 p . . . . . 0 CA--C 1.528 0.097 0 CA-C-O 121.069 0.461 . . . . 0.0 111.318 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -159.69 -165.04 1.44 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.211 1.404 . . . . 0.0 107.44 169.498 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 9.2 m -156.88 -179.5 8.26 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 119.371 0.987 . . . . 0.0 111.633 -171.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -19.72 -72.98 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 129.247 3.019 . . . . 0.0 114.429 176.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 39.8 ttpt -53.42 -52.16 60.27 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.515 1.126 . . . . 0.0 109.785 -175.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -58.86 -42.84 90.33 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 118.725 -0.655 . . . . 0.0 111.124 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 13.4 mt -61.55 -50.03 74.3 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 119.141 0.882 . . . . 0.0 111.459 176.486 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 62.0 mtpt -58.55 -46.41 86.92 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 122.191 -0.318 . . . . 0.0 110.221 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.81 -51.88 67.24 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 122.856 0.463 . . . . 0.0 110.998 173.773 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.0 mt -46.53 -61.1 1.97 Allowed 'General case' 0 C--N 1.333 -0.151 0 C-N-CA 123.747 0.819 . . . . 0.0 110.561 177.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 16.8 tt -59.41 -52.24 63.23 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 C-N-CA 119.829 -0.748 . . . . 0.0 110.157 -178.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -53.99 -50.35 66.79 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 123.604 0.761 . . . . 0.0 112.456 -175.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.06 -53.04 7.86 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 123.629 0.771 . . . . 0.0 110.266 -176.77 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 49.2 mm-40 -81.16 -24.38 37.6 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -167.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 47.4 mt . . . . . 0 CA--C 1.527 0.074 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 169.446 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 22.6 t70 . . . . . 0 C--O 1.227 -0.108 0 N-CA-C 110.194 -0.298 . . . . 0.0 110.194 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -36.4 -62.98 0.42 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.966 1.306 . . . . 0.0 113.415 -175.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 73.1 tt0 -59.35 -43.05 92.86 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.85 0.86 . . . . 0.0 111.004 -178.605 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.488 ' CD1' ' H ' ' A' ' 53' ' ' ILE . 0.9 OUTLIER -60.89 -53.72 45.24 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 N-CA-C 106.49 -1.67 . . . . 0.0 106.49 -173.834 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 66.6 t -56.01 -58.68 4.24 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 CA-C-O 118.154 -0.927 . . . . 0.0 108.647 176.256 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -41.22 -51.52 3.51 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 119.038 0.835 . . . . 0.0 112.403 -178.738 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 27.0 mt -55.92 -43.78 77.66 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -176.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 1.4 mpp? -82.07 -58.34 3.01 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.958 0.903 . . . . 0.0 109.997 -179.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -42.78 -31.29 0.46 Allowed 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 126.671 1.988 . . . . 0.0 111.954 176.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -37.2 -43.44 0.51 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.587 1.155 . . . . 0.0 113.261 172.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -58.02 -57.58 12.2 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.51 -0.744 . . . . 0.0 110.115 177.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -58.61 -45.41 89.25 Favored 'General case' 0 C--O 1.224 -0.289 0 C-N-CA 124.381 1.073 . . . . 0.0 110.361 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 43.0 tpt85 . . . . . 0 N--CA 1.451 -0.396 0 C-N-CA 126.074 1.75 . . . . 0.0 110.785 177.399 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 . . . . . 0 CA--C 1.533 0.309 0 CA-C-O 120.49 0.186 . . . . 0.0 110.657 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -122.35 143.69 34.21 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 C-N-CA 124.898 1.279 . . . . 0.0 108.647 175.246 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 17.4 p30 -92.77 -177.59 4.59 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 125.162 1.385 . . . . 0.0 111.589 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 49.4 t80 -47.37 -60.63 2.38 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.677 0.791 . . . . 0.0 112.769 175.696 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 47.8 tp60 -63.17 -34.63 78.05 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 119.489 1.041 . . . . 0.0 110.579 -175.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 72.2 mm-40 -58.26 -49.86 75.61 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.943 -0.473 . . . . 0.0 110.498 173.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -55.15 -50.02 70.35 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 122.947 0.499 . . . . 0.0 110.512 173.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 26.3 mm -57.26 -34.3 45.52 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 C-N-CA 123.207 0.603 . . . . 0.0 110.534 177.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 61.1 m -71.13 -39.29 72.09 Favored 'General case' 0 CA--C 1.531 0.227 0 O-C-N 121.568 -0.708 . . . . 0.0 110.684 176.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -57.17 -53.75 54.62 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 118.902 0.774 . . . . 0.0 109.959 173.26 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 53.6 mt -58.57 -42.35 87.77 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.804 0.335 . . . . 0.0 110.854 174.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.42 -46.05 88.09 Favored Glycine 0 CA--C 1.524 0.608 0 C-N-CA 124.244 0.926 . . . . 0.0 111.083 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.3 -49.28 74.63 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.362 0.665 . . . . 0.0 110.001 177.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -49.49 -59.63 3.58 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 122.472 1.13 . . . . 0.0 109.879 176.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -49.01 -59.75 3.35 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 113.663 -1.608 . . . . 0.0 110.254 178.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 22.7 ttp -63.87 -40.27 96.15 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.199 0.6 . . . . 0.0 112.004 -173.644 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 70.0 mt -62.94 -48.94 85.63 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 CA-C-O 117.77 -1.11 . . . . 0.0 109.679 -179.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.43 1.2 p90 -79.02 -33.54 44.75 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 117.812 -1.555 . . . . 0.0 113.975 179.117 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 32.1 m-80 -79.98 89.01 5.32 Favored 'General case' 0 C--N 1.334 -0.066 0 O-C-N 121.019 -1.051 . . . . 0.0 109.66 175.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -42.04 -42.32 2.84 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.573 0.749 . . . . 0.0 111.082 169.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.23 16.77 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 114.854 1.428 . . . . 0.0 114.854 178.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 46.9 mt . . . . . 0 CA--C 1.53 0.195 0 C-N-CA 125.136 1.374 . . . . 0.0 112.533 170.292 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.274 0 CA-C-O 121.011 0.434 . . . . 0.0 111.581 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.4 m -58.9 167.47 1.92 Allowed Pre-proline 0 CA--C 1.539 0.53 0 C-N-CA 124.688 1.195 . . . . 0.0 111.404 175.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_exo -48.27 -47.57 19.41 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 123.234 2.623 . . . . 0.0 112.988 178.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.2 mt -57.11 -49.74 74.95 Favored 'General case' 0 C--O 1.224 -0.278 0 C-N-CA 120.672 -0.411 . . . . 0.0 111.391 173.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -59.12 -40.43 85.38 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-N 118.614 0.643 . . . . 0.0 110.276 -177.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -63.02 -52.3 63.42 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.405 0.682 . . . . 0.0 110.703 176.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.47 -46.3 89.11 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.599 0.76 . . . . 0.0 111.322 -177.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 74.2 mt -52.88 -57.45 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 169.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -43.56 -46.41 7.13 Favored Glycine 0 CA--C 1.527 0.819 0 C-N-CA 125.925 1.726 . . . . 0.0 112.456 177.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 mt -54.7 -57.12 12.76 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.681 0.792 . . . . 0.0 110.774 172.742 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 11.0 mp -57.62 -42.02 82.47 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.52 -0.737 . . . . 0.0 111.976 178.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 18.6 mt -57.36 -56.42 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 C-N-CA 123.828 0.851 . . . . 0.0 110.08 175.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.92 -49.79 60.98 Favored Glycine 0 CA--C 1.52 0.404 0 N-CA-C 109.723 -1.351 . . . . 0.0 109.723 -177.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.8 mm -53.84 -46.86 63.99 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 C-N-CA 122.734 0.413 . . . . 0.0 110.558 175.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . 0.408 ' HB2' ' CE2' ' B' ' 73' ' ' TYR . 42.3 t80 -56.61 -64.2 0.95 Allowed 'General case' 0 N--CA 1.457 -0.114 0 CA-C-N 118.529 0.604 . . . . 0.0 110.004 175.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -58.28 -34.96 71.09 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 119.351 -0.356 . . . . 0.0 111.313 -169.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 64.8 tttm -50.48 -36.61 34.46 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.7 0.8 . . . . 0.0 112.177 175.514 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 77.3 m-85 -104.29 -41.95 5.63 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.186 0.595 . . . . 0.0 111.4 -178.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 96.5 p . . . . . 0 CA--C 1.531 0.221 0 O-C-N 121.556 -0.715 . . . . 0.0 111.349 -177.307 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 16.3 m170 . . . . . 0 CA--C 1.536 0.429 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 51.7 p -141.73 162.04 36.45 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.104 0.961 . . . . 0.0 110.036 177.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -161.21 179.8 8.07 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 118.045 -0.979 . . . . 0.0 108.92 172.329 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.3 t -137.93 -168.04 2.27 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 120.421 1.464 . . . . 0.0 112.254 -178.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 14.9 pttp -45.69 -51.41 12.45 Favored 'General case' 0 C--N 1.337 0.06 0 C-N-CA 126.318 1.847 . . . . 0.0 112.969 -169.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -53.34 -49.88 66.17 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 122.99 0.516 . . . . 0.0 110.346 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 19.1 mp0 -68.06 -37.12 80.93 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 119.272 -0.394 . . . . 0.0 110.419 -178.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 43.7 mt -62.91 -45.94 90.14 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 118.928 0.786 . . . . 0.0 110.93 177.18 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -57.57 -50.87 71.69 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 173.064 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 59.4 tt0 -51.42 -53.29 38.28 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.056 0.942 . . . . 0.0 110.594 178.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 12.8 mt -52.22 -65.08 0.62 Allowed 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 125.839 1.656 . . . . 0.0 109.82 177.108 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 14.3 tt -59.4 -45.51 93.44 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 120.037 -0.665 . . . . 0.0 109.934 -173.067 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 20.3 tt0 -51.16 -59.39 4.24 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.681 0.792 . . . . 0.0 111.551 177.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 9.1 mttm -78.33 -53.6 7.11 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-O 121.388 0.613 . . . . 0.0 110.815 -173.234 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 68.0 mm-40 -77.14 -21.45 54.12 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 118.278 -0.868 . . . . 0.0 112.924 -169.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 11.1 mt . . . . . 0 N--CA 1.461 0.095 0 CA-C-N 120.263 1.392 . . . . 0.0 108.948 170.185 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 . . . . . 0 CA--C 1.53 0.174 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.34 -56.31 0.15 Allowed 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 126.1 1.76 . . . . 0.0 114.479 -179.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 62.6 tt0 -63.8 -44.61 92.79 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 121.257 0.551 . . . . 0.0 110.9 -175.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 53' ' ' ILE . . . . . 0.584 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.5 mp -61.25 -52.5 60.68 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 179.855 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 73.4 t -56.29 -44.55 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 C-N-CA 124.249 1.02 . . . . 0.0 110.231 -179.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -53.92 -55.13 29.74 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 119.194 0.906 . . . . 0.0 110.497 173.013 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 46.4 mt -53.78 -42.87 68.75 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 119.18 -0.438 . . . . 0.0 111.524 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 24.5 mmt -68.45 -61.79 1.68 Allowed 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.765 0.793 . . . . 0.0 109.832 178.22 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -43.89 -43.52 6.45 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 127.085 2.154 . . . . 0.0 111.199 -177.388 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -39.13 -49.07 1.79 Allowed 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.831 1.253 . . . . 0.0 112.42 178.229 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -60.03 -56.35 22.71 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.28 0.491 . . . . 0.0 109.89 -177.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -61.79 -35.5 78.36 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 124.291 1.037 . . . . 0.0 111.482 -177.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 10.9 ttp180 -67.11 -52.24 44.28 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 123.759 0.824 . . . . 0.0 109.611 179.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 . . . . . 0 CA--C 1.52 -0.181 0 CA-C-O 119.628 -0.225 . . . . 0.0 110.558 -171.877 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 41.5 mp0 . . . . . 0 N--CA 1.45 -0.454 0 N-CA-C 108.733 -0.839 . . . . 0.0 108.733 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 20.1 m -79.02 151.48 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 173.371 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -93.15 -175.93 4.0 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 123.832 0.853 . . . . 0.0 111.179 178.221 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -46.72 -66.08 0.46 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.109 0.964 . . . . 0.0 112.622 175.458 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 10.3 tp-100 -61.39 -35.1 76.54 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 119.756 1.162 . . . . 0.0 111.454 -174.056 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -64.51 -42.51 95.77 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 119.408 1.004 . . . . 0.0 111.252 175.424 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 73' ' ' TYR . . . . . 0.408 ' CE2' ' HB2' ' B' ' 16' ' ' PHE . 0.3 OUTLIER -54.81 -52.7 61.87 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 121.286 -0.884 . . . . 0.0 109.686 170.069 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 20.8 mm -53.68 -40.61 43.53 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.375 0 C-N-CA 122.947 0.499 . . . . 0.0 109.665 177.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 91.5 m -63.63 -28.37 69.87 Favored 'General case' 0 C--N 1.332 -0.178 0 C-N-CA 123.592 0.757 . . . . 0.0 111.338 178.307 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 10.7 t80 -60.51 -54.51 44.66 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.384 0.993 . . . . 0.0 108.996 171.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 70.1 mt -64.44 -37.98 89.44 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.183 0.593 . . . . 0.0 111.703 179.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -70.63 -45.03 55.6 Favored Glycine 0 CA--C 1.523 0.541 0 N-CA-C 110.047 -1.221 . . . . 0.0 110.047 -176.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.88 -46.24 90.25 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 122.294 -0.533 . . . . 0.0 109.898 173.456 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 26.4 tp -51.52 -57.99 7.55 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.211 0.529 . . . . 0.0 109.882 175.132 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.14 -51.99 38.84 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 124.42 1.088 . . . . 0.0 110.691 177.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 57.7 ttm -56.47 -51.01 70.06 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 124.316 1.047 . . . . 0.0 110.82 -178.515 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.3 mt -66.35 -51.03 63.02 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 CA-C-O 118.088 -0.958 . . . . 0.0 109.882 -173.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.464 0.1 OUTLIER -76.98 -40.25 47.47 Favored 'General case' 0 C--N 1.347 0.478 0 CA-C-N 119.716 1.144 . . . . 0.0 113.373 -177.302 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 19.3 m-80 -82.98 64.88 7.83 Favored 'General case' 0 N--CA 1.461 0.077 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 169.166 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -47.38 -26.49 1.32 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.945 1.698 . . . . 0.0 113.961 -172.018 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -38.81 -45.16 1.11 Allowed 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.505 1.522 . . . . 0.0 111.92 167.503 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 86.8 mt . . . . . 0 CA--C 1.535 0.394 0 C-N-CA 125.235 1.414 . . . . 0.0 113.758 -177.789 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.197 0 CA-C-O 121.461 0.648 . . . . 0.0 111.98 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -53.5 163.82 0.95 Allowed Pre-proline 0 CA--C 1.54 0.568 0 C-N-CA 126.404 1.881 . . . . 0.0 111.627 172.552 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -51.65 -47.48 26.07 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 122.804 2.336 . . . . 0.0 112.309 176.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.421 HD23 ' HA ' ' A' ' 5' ' ' LEU . 8.6 mt -58.41 -50.43 73.71 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-N 118.322 0.51 . . . . 0.0 110.696 175.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -53.89 -48.81 69.73 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.147 0.431 . . . . 0.0 109.917 -178.119 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -57.78 -52.48 65.28 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.864 0.865 . . . . 0.0 110.919 177.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.31 -44.53 87.58 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.272 0.629 . . . . 0.0 111.781 -174.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 80.8 mt -54.54 -51.62 48.42 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 170.221 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.28 -49.64 14.37 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 124.358 0.98 . . . . 0.0 111.773 173.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.1 mt -55.61 -56.7 17.27 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 117.642 0.721 . . . . 0.0 111.094 174.561 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 9.9 mp -58.0 -43.39 86.58 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 119.357 0.98 . . . . 0.0 111.926 -177.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 75.4 mt -57.46 -55.88 18.5 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 C-N-CA 123.642 0.777 . . . . 0.0 110.131 174.035 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.81 -48.37 72.63 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.519 -1.032 . . . . 0.0 110.519 -177.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 7.4 mm -53.49 -48.57 57.8 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 C-N-CA 123.89 0.876 . . . . 0.0 109.975 174.278 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -56.47 -59.87 4.35 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.533 0.606 . . . . 0.0 109.96 177.076 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.6 t-80 -52.29 -38.34 58.12 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.218 1.007 . . . . 0.0 111.583 -177.014 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -56.51 -29.29 61.67 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.276 1.03 . . . . 0.0 112.163 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -110.8 -40.21 4.61 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.383 0.673 . . . . 0.0 112.262 -179.568 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 85.8 p . . . . . 0 CA--C 1.53 0.189 0 CA-C-N 119.462 1.028 . . . . 0.0 111.0 178.983 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 19.2 p . . . . . 0 N--CA 1.448 -0.534 0 N-CA-C 110.497 -0.186 . . . . 0.0 110.497 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -160.74 167.1 27.55 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 124.808 1.243 . . . . 0.0 108.219 168.553 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 6.5 t -121.12 -169.88 1.92 Allowed 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 122.391 1.091 . . . . 0.0 113.575 -172.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 43.5 pttt -45.97 -55.76 6.4 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 127.879 2.472 . . . . 0.0 113.564 -169.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -56.3 -51.83 66.76 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 -178.019 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -57.98 -41.62 83.34 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.386 0.675 . . . . 0.0 110.891 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 42.3 mt -65.73 -48.76 70.83 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.496 0.589 . . . . 0.0 111.862 178.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -58.3 -46.15 86.66 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 121.786 -0.571 . . . . 0.0 109.805 176.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -58.05 -49.33 77.26 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-O 118.889 -0.577 . . . . 0.0 110.42 174.575 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.1 mt -48.24 -52.3 21.67 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 119.513 1.051 . . . . 0.0 110.114 177.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 49.3 mt -56.56 -62.63 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.206 174.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.5 tt0 -49.2 -46.74 46.1 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.325 0.65 . . . . 0.0 112.599 -173.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.9 mmpt? -80.94 -53.92 6.03 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 125.592 1.557 . . . . 0.0 110.149 -171.319 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -95.22 -14.57 23.94 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -168.005 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.7 mt . . . . . 0 C--N 1.337 0.034 0 C-N-CA 125.327 1.451 . . . . 0.0 108.059 173.3 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.6 p-10 . . . . . 0 N--CA 1.464 0.267 0 N-CA-C 110.253 -0.277 . . . . 0.0 110.253 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -36.2 -58.82 0.66 Allowed 'General case' 0 C--O 1.226 -0.17 0 C-N-CA 125.352 1.461 . . . . 0.0 113.593 -173.208 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -65.74 -39.87 91.55 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 120.771 0.319 . . . . 0.0 111.057 -173.076 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.68 HD12 ' H ' ' A' ' 53' ' ' ILE . 2.1 mp -61.14 -54.88 29.16 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 178.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 80.6 t -56.25 -45.31 81.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 C-N-CA 123.973 0.909 . . . . 0.0 110.285 -179.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.19 -52.83 63.73 Favored 'General case' 0 C--O 1.23 0.053 0 CA-C-N 118.846 0.748 . . . . 0.0 110.235 176.367 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 61.5 mt -55.0 -40.44 70.13 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 119.282 -0.39 . . . . 0.0 111.192 -179.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.25 -67.74 0.44 Allowed 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 118.523 0.601 . . . . 0.0 109.645 174.23 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -39.7 -41.3 1.06 Allowed 'General case' 0 C--N 1.34 0.152 0 C-N-CA 127.37 2.268 . . . . 0.0 112.097 -177.125 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -38.64 -49.96 1.58 Allowed 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.825 1.25 . . . . 0.0 112.19 175.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.7 pp -60.87 -41.56 96.19 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 118.333 0.515 . . . . 0.0 110.95 -176.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -71.46 -42.72 67.82 Favored 'General case' 0 N--CA 1.457 -0.11 0 C-N-CA 123.619 0.768 . . . . 0.0 109.762 -178.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 14.5 ttm180 . . . . . 0 N--CA 1.453 -0.308 0 C-N-CA 123.894 0.877 . . . . 0.0 110.208 178.464 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 . . . . . 0 CA--C 1.534 0.328 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 11.0 m -79.55 143.3 12.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 170.206 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -83.38 167.81 17.18 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 122.78 0.432 . . . . 0.0 111.382 177.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 61.1 t80 -37.4 -59.18 0.78 Allowed 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.508 1.123 . . . . 0.0 113.149 177.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 53.8 tp60 -64.9 -32.22 73.82 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 119.716 1.144 . . . . 0.0 111.153 -175.738 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -68.87 -40.27 79.38 Favored 'General case' 0 CA--C 1.533 0.304 0 O-C-N 121.537 -0.727 . . . . 0.0 110.539 176.672 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -56.14 -51.94 66.13 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 169.584 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.416 ' CG2' ' CG2' ' B' ' 74' ' ' ILE . 24.5 mm -56.78 -35.86 47.5 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 O-C-N 121.915 -0.491 . . . . 0.0 110.305 176.669 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 90.2 m -71.69 -34.52 69.73 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 119.217 0.917 . . . . 0.0 111.42 176.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -58.73 -51.93 67.86 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 119.106 0.866 . . . . 0.0 108.923 171.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 64.3 mt -59.96 -40.92 90.68 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 120.926 0.393 . . . . 0.0 111.322 174.159 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -59.7 -47.28 91.69 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 110.533 -1.027 . . . . 0.0 110.533 -179.772 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.03 -48.3 82.4 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.925 0.89 . . . . 0.0 109.694 176.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 8.9 tp -51.06 -60.27 3.28 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-O 121.981 0.896 . . . . 0.0 110.002 177.031 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -49.14 -54.93 14.02 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 125.518 1.527 . . . . 0.0 110.528 179.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 18.4 ttp -67.92 -33.6 75.0 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.772 0.829 . . . . 0.0 111.99 -174.199 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 90.9 mt -67.49 -58.42 6.29 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.346 0 CA-C-O 118.407 -0.806 . . . . 0.0 108.99 176.3 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.417 0.7 OUTLIER -70.8 -38.89 73.37 Favored 'General case' 0 C--N 1.346 0.436 0 C-N-CA 118.173 -1.411 . . . . 0.0 112.521 -174.542 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 29.7 m-80 -82.18 65.44 7.31 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 168.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -46.99 -32.58 3.99 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.517 1.127 . . . . 0.0 113.004 -172.104 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.94 -52.25 0.43 Allowed 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.85 1.66 . . . . 0.0 112.494 168.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 90.1 mt . . . . . 0 CA--C 1.533 0.308 0 C-N-CA 124.2 1.0 . . . . 0.0 113.455 -174.634 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.216 0 CA-C-O 120.847 0.356 . . . . 0.0 110.222 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.7 m -51.26 159.86 1.02 Allowed Pre-proline 0 CA--C 1.537 0.468 0 C-N-CA 124.959 1.304 . . . . 0.0 110.688 173.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_exo -44.81 -49.87 9.09 Favored 'Trans proline' 0 N--CA 1.459 -0.52 0 C-N-CA 123.276 2.65 . . . . 0.0 113.401 -178.423 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.4 mt -57.95 -53.42 58.47 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 174.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -58.35 -40.44 82.22 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 118.265 0.484 . . . . 0.0 110.029 -175.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -64.12 -50.69 67.27 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.462 1.105 . . . . 0.0 110.52 178.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.35 -46.12 91.54 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.602 0.715 . . . . 0.0 111.103 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 64.9 mt -52.8 -53.01 23.13 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 170.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.76 -47.25 24.75 Favored Glycine 0 CA--C 1.527 0.796 0 C-N-CA 125.172 1.368 . . . . 0.0 111.784 176.082 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 mt -55.93 -55.34 33.82 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 117.606 0.703 . . . . 0.0 110.89 173.63 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -57.54 -43.66 84.55 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 118.864 0.757 . . . . 0.0 111.612 -179.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 89.1 mt -58.35 -52.75 55.32 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 C-N-CA 123.554 0.741 . . . . 0.0 110.69 174.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.0 -51.97 50.08 Favored Glycine 0 CA--C 1.523 0.543 0 N-CA-C 109.614 -1.394 . . . . 0.0 109.614 -178.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 9.1 mm -53.51 -49.93 52.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 C-N-CA 123.635 0.774 . . . . 0.0 110.474 175.377 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -51.76 -59.46 4.28 Favored 'General case' 0 C--N 1.339 0.134 0 CA-C-O 120.929 0.395 . . . . 0.0 110.059 178.321 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 67.9 t60 -55.04 -46.39 75.31 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.262 0.625 . . . . 0.0 110.635 -177.632 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -51.15 -28.83 11.89 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 125.546 1.539 . . . . 0.0 112.721 -179.423 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -132.27 44.6 2.87 Favored 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 119.006 0.821 . . . . 0.0 110.01 173.367 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 58.6 p . . . . . 0 CA--C 1.533 0.305 0 CA-C-O 121.601 0.715 . . . . 0.0 111.769 -176.986 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 19.2 m80 . . . . . 0 CA--C 1.54 0.568 0 CA-C-O 119.755 -0.164 . . . . 0.0 111.358 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 3.4 p -128.84 169.85 14.08 Favored 'General case' 0 C--O 1.232 0.151 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 169.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . 0.427 HD12 ' CG2' ' B' ' 68' ' ' VAL . 4.3 pp -159.34 -170.84 3.1 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.593 0.757 . . . . 0.0 109.619 175.247 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 14.4 m -149.69 178.82 8.52 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.125 -0.984 . . . . 0.0 111.357 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 19.4 pttm -37.23 -53.2 1.06 Allowed 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 126.576 1.95 . . . . 0.0 113.727 -179.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 23.1 ttmm -50.98 -50.35 58.39 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.782 0.833 . . . . 0.0 110.544 178.119 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 25.8 mp0 -67.39 -39.01 85.56 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 118.723 -0.656 . . . . 0.0 110.143 -178.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 78.0 mt -60.36 -46.43 89.98 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.373 0.988 . . . . 0.0 111.127 175.476 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -56.8 -51.43 68.96 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 175.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -55.64 -48.22 75.33 Favored 'General case' 0 C--O 1.22 -0.448 0 CA-C-N 117.861 0.3 . . . . 0.0 111.361 175.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 15.1 mt -51.77 -53.52 38.84 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 121.504 -0.748 . . . . 0.0 109.776 -178.739 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 1.4 mp -57.13 -58.14 7.13 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 174.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -53.5 -47.77 69.58 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.574 0.75 . . . . 0.0 112.037 -172.085 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 10.7 mmpt? -82.66 -49.39 9.86 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 125.204 1.402 . . . . 0.0 110.211 -173.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 52.7 mm-40 -98.98 -2.47 37.29 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-O 117.248 -1.358 . . . . 0.0 114.424 -167.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 72.1 mt . . . . . 0 N--CA 1.462 0.175 0 CA-C-N 120.673 1.579 . . . . 0.0 110.214 169.666 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 . . . . . 0 N--CA 1.464 0.243 0 N-CA-C 114.959 1.466 . . . . 0.0 114.959 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.94 -60.58 0.16 Allowed 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 125.851 1.661 . . . . 0.0 113.524 -178.362 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -68.55 -34.57 76.08 Favored 'General case' 0 N--CA 1.457 -0.111 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -174.085 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 53' ' ' ILE . . . . . 0.509 ' N ' HD12 ' B' ' 53' ' ' ILE . 1.2 mp -65.87 -52.54 48.25 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 -178.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 80.3 t -54.31 -45.49 68.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 C-N-CA 123.699 0.799 . . . . 0.0 110.093 174.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.41 -50.64 72.36 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 118.482 0.583 . . . . 0.0 110.926 177.263 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 54.4 mt -56.19 -39.87 73.09 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.202 0.601 . . . . 0.0 111.284 178.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.44 -64.95 0.75 Allowed 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 118.762 0.71 . . . . 0.0 109.085 174.186 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -40.51 -42.51 1.66 Allowed 'General case' 0 N--CA 1.463 0.209 0 C-N-CA 126.637 1.975 . . . . 0.0 111.943 -178.147 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -38.13 -48.65 1.26 Allowed 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 126.001 1.72 . . . . 0.0 112.634 177.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.6 pp -63.11 -42.23 99.51 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 121.078 -0.249 . . . . 0.0 110.833 -176.288 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -73.59 -37.76 65.34 Favored 'General case' 0 N--CA 1.457 -0.085 0 C-N-CA 123.791 0.836 . . . . 0.0 110.257 -178.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 15.6 ttm180 -58.38 -48.5 80.4 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.325 0.65 . . . . 0.0 109.614 175.092 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 . . . . . 0 C--O 1.232 0.166 0 C-N-CA 122.222 0.209 . . . . 0.0 111.311 -174.412 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 26.9 mp0 . . . . . 0 N--CA 1.453 -0.277 0 N-CA-C 109.368 -0.604 . . . . 0.0 109.368 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . 0.427 ' CG2' HD12 ' B' ' 29' ' ' LEU . 29.5 m -85.91 155.86 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 CA-C-O 121.33 0.586 . . . . 0.0 109.896 -177.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 16.7 p30 -105.17 -176.79 3.18 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 126.184 1.794 . . . . 0.0 110.928 179.426 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -52.93 -63.48 1.13 Allowed 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 123.637 0.775 . . . . 0.0 112.183 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -62.76 -32.68 73.87 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 119.703 1.138 . . . . 0.0 111.327 -175.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -59.16 -50.52 73.72 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 119.525 1.057 . . . . 0.0 110.666 173.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -53.9 -49.75 67.9 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.957 -0.464 . . . . 0.0 110.227 173.245 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 0.416 ' CG2' ' CG2' ' A' ' 74' ' ' ILE . 26.2 mm -60.85 -27.18 40.65 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 O-C-N 121.934 -0.479 . . . . 0.0 111.18 177.343 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 83.6 m -76.12 -33.94 59.46 Favored 'General case' 0 C--N 1.333 -0.114 0 O-C-N 120.898 -1.126 . . . . 0.0 110.154 173.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -57.34 -57.98 10.26 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 169.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 48.4 mt -61.37 -40.31 93.84 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 120.943 0.401 . . . . 0.0 111.996 179.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.3 -47.06 65.81 Favored Glycine 0 CA--C 1.524 0.651 0 N-CA-C 110.721 -0.952 . . . . 0.0 110.721 -176.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.28 -44.58 87.54 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 121.867 -0.784 . . . . 0.0 110.174 176.228 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 13.9 tp -48.29 -56.83 7.04 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.604 0.761 . . . . 0.0 110.145 172.55 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.05 -55.0 23.39 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.474 1.11 . . . . 0.0 110.612 175.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 39.5 ttm -51.33 -47.13 62.79 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.243 1.017 . . . . 0.0 110.982 -178.136 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 60.6 mt -68.8 -61.21 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-O 118.321 -0.847 . . . . 0.0 110.566 178.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.39 0.3 OUTLIER -65.7 -44.47 86.06 Favored 'General case' 0 C--N 1.346 0.434 0 C-N-CA 117.891 -1.524 . . . . 0.0 112.02 -171.331 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 64.7 m-80 -82.94 62.57 6.57 Favored 'General case' 0 C--O 1.228 -0.047 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 169.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -49.21 -30.07 6.49 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.196 1.398 . . . . 0.0 112.268 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -40.37 -37.94 0.74 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.795 1.638 . . . . 0.0 113.138 169.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 28.5 mt . . . . . 0 CA--C 1.53 0.185 0 C-N-CA 123.788 0.835 . . . . 0.0 111.988 176.831 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.258 0 CA-C-O 121.084 0.468 . . . . 0.0 110.75 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.1 m -57.39 165.78 1.95 Allowed Pre-proline 0 CA--C 1.54 0.594 0 C-N-CA 124.915 1.286 . . . . 0.0 111.885 178.039 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -47.19 -47.43 17.11 Favored 'Trans proline' 0 N--CA 1.458 -0.578 0 C-N-CA 123.575 2.85 . . . . 0.0 113.376 178.735 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.7 mt -55.42 -49.62 71.93 Favored 'General case' 0 C--N 1.341 0.204 0 CA-C-N 118.01 0.368 . . . . 0.0 111.495 173.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -61.52 -41.31 97.13 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 -176.391 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 17.0 tt0 -60.48 -51.78 67.99 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.33 0.652 . . . . 0.0 110.831 175.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.06 -45.83 90.35 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.527 0.731 . . . . 0.0 111.227 -177.296 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 66.7 mt -53.1 -53.5 22.16 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 169.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -45.78 -47.83 13.49 Favored Glycine 0 CA--C 1.528 0.902 0 C-N-CA 125.188 1.375 . . . . 0.0 112.156 175.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.0 mt -54.95 -56.48 19.19 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 117.733 0.766 . . . . 0.0 110.861 173.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.4 mp -58.17 -43.95 87.73 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 121.611 -0.681 . . . . 0.0 111.601 -179.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 60.7 mt -55.41 -56.04 13.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.18 0 C-N-CA 123.727 0.811 . . . . 0.0 109.975 174.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.01 -49.63 61.92 Favored Glycine 0 CA--C 1.523 0.56 0 N-CA-C 110.268 -1.133 . . . . 0.0 110.268 -177.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 8.8 mm -53.34 -48.5 56.16 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 C-N-CA 123.242 0.617 . . . . 0.0 110.454 176.52 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -56.54 -60.93 2.82 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 121.684 0.754 . . . . 0.0 109.892 175.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -53.76 -37.39 63.36 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.854 1.262 . . . . 0.0 111.616 -172.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.5 tttp -50.28 -36.92 33.59 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.2 1.0 . . . . 0.0 111.855 177.151 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -102.28 -52.14 3.2 Favored 'General case' 0 CA--C 1.528 0.111 0 C-N-CA 123.064 0.545 . . . . 0.0 109.682 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.6 m . . . . . 0 N--CA 1.453 -0.292 0 O-C-N 121.759 -0.588 . . . . 0.0 112.431 -175.549 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.9 p . . . . . 0 N--CA 1.453 -0.309 0 CA-C-O 121.08 0.467 . . . . 0.0 111.431 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -151.62 164.34 37.1 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 124.088 0.955 . . . . 0.0 109.079 168.12 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 84.3 p -87.04 165.28 15.93 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.66 1.184 . . . . 0.0 113.125 -172.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 24.2 pttm -48.83 -47.34 42.54 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.395 168.075 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -57.28 -53.28 59.88 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 124.542 1.137 . . . . 0.0 109.37 178.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -56.62 -43.65 80.42 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 118.208 -0.901 . . . . 0.0 111.812 178.146 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.8 mt -60.4 -52.29 65.84 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 119.881 1.219 . . . . 0.0 111.597 175.549 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.9 mtmt -58.48 -38.21 77.12 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 122.374 0.27 . . . . 0.0 110.803 -178.565 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -60.62 -70.39 0.18 Allowed 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 168.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.3 mt -32.16 -60.23 0.28 Allowed 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 126.175 1.79 . . . . 0.0 112.341 -176.397 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 15.4 tt -56.34 -54.17 31.21 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 O-C-N 123.464 0.477 . . . . 0.0 109.874 -173.592 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -69.01 -40.46 78.66 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.851 -0.531 . . . . 0.0 111.733 -176.389 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.8 mmpt? -60.93 -54.26 47.14 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 123.692 0.797 . . . . 0.0 109.691 -178.841 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 65.8 mm-40 -84.68 -49.96 8.05 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.399 -169.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 98.4 mt . . . . . 0 C--N 1.339 0.128 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 170.428 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 . . . . . 0 N--CA 1.462 0.165 0 N-CA-C 113.748 1.018 . . . . 0.0 113.748 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -36.87 -51.16 0.89 Allowed 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 124.661 1.184 . . . . 0.0 112.799 179.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -65.95 -39.32 90.34 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 121.256 0.55 . . . . 0.0 111.103 -175.195 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.509 ' N ' HD12 ' A' ' 53' ' ' ILE . 1.1 mp -65.36 -51.98 57.71 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 N-CA-C 106.904 -1.517 . . . . 0.0 106.904 -179.708 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 84.6 t -56.69 -44.17 80.76 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 C-N-CA 123.892 0.877 . . . . 0.0 110.324 178.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -56.65 -53.45 57.5 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 118.65 0.659 . . . . 0.0 110.195 173.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 40.8 mt -53.13 -44.3 67.61 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 119.204 -0.427 . . . . 0.0 111.521 178.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 26.2 mmt -64.89 -57.82 7.79 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.797 0.808 . . . . 0.0 109.885 177.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -56.29 -32.94 65.05 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 125.272 1.429 . . . . 0.0 111.835 -173.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -38.59 -47.66 1.34 Allowed 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 125.314 1.446 . . . . 0.0 112.397 -178.191 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -55.83 -48.33 75.65 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 122.348 0.259 . . . . 0.0 110.708 -178.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -67.61 -45.34 75.72 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 123.139 0.576 . . . . 0.0 110.198 176.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 14.2 ttt85 . . . . . 0 CA--C 1.533 0.291 0 C-N-CA 123.954 0.902 . . . . 0.0 111.014 -178.932 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.5 mp0 . . . . . 0 CA--C 1.53 0.198 0 CA-C-O 120.202 0.049 . . . . 0.0 111.107 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 15.5 m -137.03 156.31 34.13 Favored 'Isoleucine or valine' 0 C--O 1.235 0.303 0 C-N-CA 125.37 1.468 . . . . 0.0 108.844 168.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -88.67 168.48 12.48 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 124.016 0.926 . . . . 0.0 111.622 175.142 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -36.63 -62.0 0.49 Allowed 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.512 1.125 . . . . 0.0 113.447 172.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 43.7 tp60 -63.29 -34.09 76.94 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 120.851 -1.156 . . . . 0.0 111.235 -174.28 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -66.28 -41.4 89.87 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.366 -0.834 . . . . 0.0 110.371 175.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -54.49 -49.27 70.53 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 121.614 -0.678 . . . . 0.0 109.651 169.74 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.407 ' CG2' ' CG2' ' B' ' 74' ' ' ILE . 29.6 mm -58.65 -32.8 47.09 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 O-C-N 121.764 -0.585 . . . . 0.0 110.676 175.3 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 25.5 m -72.13 -30.97 65.58 Favored 'General case' 0 CA--C 1.534 0.345 0 O-C-N 121.232 -0.917 . . . . 0.0 111.253 175.363 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -61.77 -56.48 19.05 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.083 -1.011 . . . . 0.0 108.739 171.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 49.2 mt -61.49 -41.97 98.08 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 120.875 0.369 . . . . 0.0 111.418 178.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.8 -46.36 89.88 Favored Glycine 0 CA--C 1.523 0.587 0 N-CA-C 110.663 -0.975 . . . . 0.0 110.663 -178.215 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.97 -45.91 92.84 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 117.97 0.885 . . . . 0.0 110.423 174.758 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 16.8 tp -51.73 -55.74 17.85 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.18 0.514 . . . . 0.0 109.807 176.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.83 -56.14 15.74 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 124.75 1.22 . . . . 0.0 110.163 179.261 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 54.5 ttm -50.43 -52.6 36.32 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 125.6 1.56 . . . . 0.0 110.574 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 71.3 mt -64.84 -64.41 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.346 0 CA-C-O 118.748 -0.644 . . . . 0.0 109.403 -177.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.448 0.1 OUTLIER -67.47 -37.1 82.39 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 118.314 -1.354 . . . . 0.0 113.253 -169.245 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 24.1 m-80 -81.51 68.79 7.98 Favored 'General case' 0 N--CA 1.461 0.101 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 170.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -37.62 -46.64 0.88 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.503 1.521 . . . . 0.0 111.619 -176.074 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -30.93 -53.51 0.19 Allowed 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 126.756 2.022 . . . . 0.0 113.506 171.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 18.7 mt . . . . . 0 C--O 1.224 -0.261 0 C-N-CA 123.996 0.919 . . . . 0.0 111.95 -178.293 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.239 0 CA-C-O 120.794 0.33 . . . . 0.0 110.621 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 13.0 m -50.74 156.37 1.63 Allowed Pre-proline 0 CA--C 1.542 0.656 0 C-N-CA 123.56 0.744 . . . . 0.0 111.008 170.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -47.11 -51.5 9.29 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 123.23 2.62 . . . . 0.0 113.465 -178.01 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 4.9 mt -52.79 -46.89 67.84 Favored 'General case' 0 C--O 1.227 -0.124 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 172.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -63.48 -40.62 97.58 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 118.16 0.436 . . . . 0.0 110.1 -177.045 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 14.1 tp60 -63.4 -46.3 87.07 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 122.438 0.295 . . . . 0.0 110.7 175.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.76 -47.02 85.33 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.357 0.599 . . . . 0.0 110.872 -179.157 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 65.1 mt -53.15 -53.39 23.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 169.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.29 -44.8 21.11 Favored Glycine 0 CA--C 1.527 0.822 0 C-N-CA 125.588 1.566 . . . . 0.0 112.02 176.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.6 mt -57.27 -55.57 33.11 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 117.569 0.685 . . . . 0.0 110.587 173.612 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.9 mp -57.86 -41.99 83.58 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 118.996 0.816 . . . . 0.0 111.647 179.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 66.7 mt -57.13 -56.37 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 C-N-CA 123.841 0.856 . . . . 0.0 110.736 173.448 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.07 -50.55 58.62 Favored Glycine 0 CA--C 1.521 0.444 0 N-CA-C 109.751 -1.34 . . . . 0.0 109.751 -177.206 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 12.5 mm -52.1 -49.06 41.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 C-N-CA 123.47 0.708 . . . . 0.0 110.474 174.341 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -55.49 -65.36 0.6 Allowed 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 118.31 0.505 . . . . 0.0 110.18 178.335 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -58.92 -30.67 68.01 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 118.205 -0.902 . . . . 0.0 112.707 -174.398 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 65.3 tttp -49.13 -36.71 19.75 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 119.301 0.955 . . . . 0.0 111.293 173.33 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -100.68 -56.73 2.26 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 122.935 0.494 . . . . 0.0 110.169 177.459 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 CA--C 1.533 0.326 0 CA-C-N 118.832 0.742 . . . . 0.0 111.589 -176.83 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 23.6 t-160 . . . . . 0 N--CA 1.451 -0.393 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 32.2 p -133.48 160.83 36.25 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 125.177 1.391 . . . . 0.0 111.429 -174.208 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -161.34 177.72 9.88 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.831 1.252 . . . . 0.0 108.668 168.477 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.4 t -131.83 -169.44 2.2 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 120.259 1.39 . . . . 0.0 112.241 -175.112 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 19.2 pttp -42.25 -53.54 4.07 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 127.877 2.471 . . . . 0.0 113.227 -174.062 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 3.2 tppp? -55.67 -53.41 56.94 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 123.517 0.727 . . . . 0.0 109.568 -178.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 28.2 mp0 -64.44 -38.04 89.64 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.289 -176.65 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 43.6 mt -61.9 -52.59 63.46 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 118.542 0.61 . . . . 0.0 111.228 177.591 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -61.88 -43.78 98.14 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.545 -0.722 . . . . 0.0 110.506 178.413 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 71.6 tt0 -53.24 -51.96 60.51 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.758 0.823 . . . . 0.0 110.363 174.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 7.9 mt -49.49 -56.95 8.01 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 124.552 1.141 . . . . 0.0 110.13 177.391 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 33.7 mm -53.92 -58.99 2.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 177.503 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -54.31 -47.06 72.88 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.272 0.629 . . . . 0.0 112.425 -172.166 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -78.1 -56.28 4.6 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 122.096 -0.377 . . . . 0.0 110.745 -178.316 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -82.59 -20.55 36.26 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 -167.163 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 76.1 mt . . . . . 0 N--CA 1.457 -0.115 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 168.779 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 . . . . . 0 C--O 1.226 -0.136 0 N-CA-C 114.184 1.179 . . . . 0.0 114.184 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.4 -57.41 0.15 Allowed 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 126.027 1.731 . . . . 0.0 113.906 -178.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -67.4 -41.91 84.15 Favored 'General case' 0 N--CA 1.457 -0.083 0 CA-C-O 120.849 0.356 . . . . 0.0 111.166 -174.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 53' ' ' ILE . . . . . 0.612 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.4 mp -60.65 -52.08 65.64 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 N-CA-C 107.066 -1.457 . . . . 0.0 107.066 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 78.4 t -54.49 -53.37 31.52 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 C-N-CA 123.914 0.886 . . . . 0.0 109.428 177.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -50.28 -55.17 16.57 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 119.317 0.962 . . . . 0.0 110.927 176.932 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 68.1 mt -54.67 -43.47 72.45 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 122.593 0.357 . . . . 0.0 111.655 -175.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -75.55 -59.67 2.65 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 118.097 0.408 . . . . 0.0 111.09 177.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -40.88 -43.71 2.12 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 126.458 1.903 . . . . 0.0 111.447 178.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -38.52 -49.01 1.47 Allowed 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 125.046 1.338 . . . . 0.0 112.547 176.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -58.6 -47.02 85.72 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 -176.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -67.91 -44.04 77.85 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 122.736 0.415 . . . . 0.0 110.724 178.44 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 11.2 ttp180 -56.55 -46.28 80.79 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.664 0.786 . . . . 0.0 110.095 -178.657 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 . . . . . 0 N--CA 1.454 -0.236 0 C-N-CA 122.879 0.472 . . . . 0.0 111.179 -174.904 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 . . . . . 0 N--CA 1.452 -0.359 0 N-CA-C 106.237 -1.764 . . . . 0.0 106.237 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 12.2 m -78.17 140.22 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 -179.181 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -81.36 167.06 19.88 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.551 0.215 . . . . 0.0 110.71 175.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -32.37 -61.04 0.27 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.978 1.311 . . . . 0.0 112.902 171.589 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 37.8 tp60 -61.35 -33.3 73.39 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.604 1.093 . . . . 0.0 112.128 -174.726 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -72.53 -38.77 67.94 Favored 'General case' 0 C--O 1.236 0.35 0 O-C-N 121.338 -0.851 . . . . 0.0 110.16 177.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -56.14 -50.74 70.27 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 169.675 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 0.407 ' CG2' ' CG2' ' A' ' 74' ' ' ILE . 25.8 mm -55.82 -41.17 65.31 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 175.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 58.4 m -60.03 -37.95 81.28 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 118.976 0.807 . . . . 0.0 110.94 176.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 20.7 t80 -57.09 -53.97 52.1 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 121.726 -0.608 . . . . 0.0 109.842 174.223 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 60.2 mt -62.98 -38.27 90.45 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.979 0.419 . . . . 0.0 111.893 179.113 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.65 -43.51 84.99 Favored Glycine 0 CA--C 1.522 0.508 0 N-CA-C 110.0 -1.24 . . . . 0.0 110.0 -178.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.74 -48.31 82.37 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 117.553 0.676 . . . . 0.0 109.881 173.438 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 9.1 tp -50.39 -57.7 7.37 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 121.429 0.633 . . . . 0.0 110.054 175.426 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.5 -56.64 10.71 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 124.877 1.271 . . . . 0.0 110.433 179.018 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 43.8 ttm -52.57 -49.66 64.51 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 125.555 1.542 . . . . 0.0 110.665 -179.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 58.3 mt -69.84 -50.02 52.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-O 117.894 -1.051 . . . . 0.0 110.262 -172.503 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.451 1.2 p90 -76.52 -37.93 55.94 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 120.166 1.348 . . . . 0.0 113.381 -178.573 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -81.29 67.4 7.21 Favored 'General case' 0 N--CA 1.463 0.203 0 O-C-N 121.102 -0.999 . . . . 0.0 108.692 173.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -41.54 -42.03 2.29 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.259 1.424 . . . . 0.0 111.464 179.303 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.5 -47.67 0.23 Allowed 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 126.192 1.797 . . . . 0.0 113.575 172.063 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 47.7 mt . . . . . 0 N--CA 1.457 -0.082 0 C-N-CA 122.807 0.443 . . . . 0.0 110.832 178.431 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.236 0 CA-C-O 120.737 0.303 . . . . 0.0 110.533 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.1 m -51.13 157.62 1.46 Allowed Pre-proline 0 CA--C 1.538 0.488 0 C-N-CA 125.031 1.332 . . . . 0.0 111.427 176.272 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_exo -46.45 -49.64 11.53 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 123.28 2.653 . . . . 0.0 112.929 -179.188 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.0 mt -58.54 -45.78 88.17 Favored 'General case' 0 C--O 1.225 -0.217 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 175.489 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -61.34 -43.26 99.16 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-N 118.3 0.5 . . . . 0.0 109.656 -177.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -60.71 -49.78 76.13 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.518 0.727 . . . . 0.0 110.573 176.413 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.47 -45.89 90.96 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.276 0.63 . . . . 0.0 111.388 -178.349 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 65.5 mt -53.78 -51.64 42.29 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 170.463 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.73 -48.84 17.59 Favored Glycine 0 CA--C 1.527 0.81 0 C-N-CA 124.733 1.159 . . . . 0.0 112.013 174.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.1 mt -55.51 -56.49 19.66 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 117.749 0.775 . . . . 0.0 111.062 174.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.23 -42.74 86.97 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 118.586 0.63 . . . . 0.0 111.451 -178.574 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 79.0 mt -58.24 -52.34 60.03 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 C-N-CA 123.578 0.751 . . . . 0.0 110.586 173.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.72 -50.65 59.7 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.069 -1.212 . . . . 0.0 110.069 -178.378 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 8.6 mm -52.94 -48.82 50.98 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 C-N-CA 123.306 0.642 . . . . 0.0 110.093 175.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -55.57 -59.01 5.43 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 120.71 0.291 . . . . 0.0 110.527 177.634 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 5.6 t-80 -55.36 -39.83 70.55 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 124.252 1.021 . . . . 0.0 111.061 -175.544 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -48.25 -34.49 10.39 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.653 0.781 . . . . 0.0 112.064 -178.37 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -107.16 -53.59 2.59 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.41 0.684 . . . . 0.0 109.793 178.1 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.8 m . . . . . 0 N--CA 1.454 -0.241 0 C-N-CA 123.894 0.878 . . . . 0.0 112.267 -172.909 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 6.9 p . . . . . 0 CA--C 1.533 0.294 0 CA-C-O 120.771 0.319 . . . . 0.0 110.84 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -154.44 174.63 14.62 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 124.342 1.057 . . . . 0.0 109.258 169.608 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.6 p -127.0 168.06 15.06 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.52 1.128 . . . . 0.0 112.831 -171.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.3 pttp -32.26 -61.34 0.26 Allowed 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 127.515 2.326 . . . . 0.0 113.921 177.47 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 20.5 tptp -54.66 -47.25 73.78 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 121.881 -0.512 . . . . 0.0 111.368 -179.27 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -61.81 -40.99 97.19 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 119.183 -0.437 . . . . 0.0 109.932 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 26.2 mt -63.13 -48.38 78.72 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 118.264 0.484 . . . . 0.0 111.437 176.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 9.1 mtpm? -61.93 -36.55 81.7 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.291 0.636 . . . . 0.0 110.966 179.193 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.58 -54.22 30.96 Favored 'General case' 0 C--O 1.224 -0.262 0 O-C-N 122.103 -0.373 . . . . 0.0 110.656 169.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.1 mt -43.77 -71.93 0.07 Allowed 'General case' 0 C--O 1.227 -0.108 0 C-N-CA 124.638 1.175 . . . . 0.0 110.29 178.288 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 12.9 tt -50.72 -50.66 22.26 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 CA-C-O 121.777 0.799 . . . . 0.0 110.212 -170.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -53.9 -47.13 71.45 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 126.324 1.85 . . . . 0.0 111.87 177.657 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.26 -55.37 5.78 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.944 0.498 . . . . 0.0 110.658 -175.668 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . 0.261 0.0 OUTLIER -91.27 -7.58 50.75 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 114.898 1.444 . . . . 0.0 114.898 -168.587 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 62.5 mt . . . . . 0 C--O 1.231 0.109 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 167.893 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 . . . . . 0 CA--C 1.531 0.217 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -28.53 -57.53 0.13 Allowed 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 126.909 2.083 . . . . 0.0 113.89 178.025 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 63.4 tt0 -66.84 -40.99 88.15 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 121.075 0.464 . . . . 0.0 110.901 -173.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.608 HD12 ' H ' ' A' ' 53' ' ' ILE . 1.8 mp -64.8 -51.24 69.6 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 -179.776 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 82.8 t -55.68 -43.06 72.03 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 C-N-CA 123.964 0.906 . . . . 0.0 110.098 177.559 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.27 -52.2 66.69 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 119.583 1.083 . . . . 0.0 111.003 174.673 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 37.5 mt -53.36 -41.44 65.84 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 119.491 -0.29 . . . . 0.0 111.401 179.156 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.5 -62.4 1.42 Allowed 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.399 0.545 . . . . 0.0 110.139 176.43 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -43.53 -39.98 3.7 Favored 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 126.996 2.118 . . . . 0.0 111.572 -177.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -39.0 -49.7 1.72 Allowed 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 124.165 0.986 . . . . 0.0 112.261 173.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.4 mp -60.84 -48.37 82.12 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 -177.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -61.29 -54.0 49.58 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.095 0.558 . . . . 0.0 109.73 179.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.6 ttm180 . . . . . 0 N--CA 1.453 -0.291 0 C-N-CA 124.599 1.16 . . . . 0.0 110.219 178.02 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 . . . . . 0 N--CA 1.453 -0.304 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.7 m -132.0 151.1 34.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 C-N-CA 125.791 1.636 . . . . 0.0 106.976 169.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -90.31 170.94 9.83 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 123.321 0.648 . . . . 0.0 111.037 175.253 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 73.6 t80 -34.51 -63.89 0.28 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.987 1.315 . . . . 0.0 113.123 171.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 50.3 tp60 -63.26 -32.34 73.73 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.768 1.167 . . . . 0.0 111.496 -173.064 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -68.45 -41.2 80.61 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 121.262 -0.899 . . . . 0.0 110.246 176.485 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -56.58 -50.54 71.64 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 170.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.6 mm -56.28 -38.3 54.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 O-C-N 121.848 -0.533 . . . . 0.0 110.087 176.463 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 90.4 m -66.63 -38.24 86.5 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 121.465 -0.772 . . . . 0.0 111.035 175.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -54.85 -54.49 41.68 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 172.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 53.8 mt -59.95 -40.89 90.56 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 111.763 0.283 . . . . 0.0 111.763 176.272 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.07 -47.05 91.8 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 110.895 -0.882 . . . . 0.0 110.895 -177.179 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.32 -45.21 81.09 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.37 0.668 . . . . 0.0 109.948 177.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 59.0 tp -49.53 -58.67 4.76 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.369 0.604 . . . . 0.0 109.983 173.573 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -48.59 -58.57 4.51 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 124.46 1.104 . . . . 0.0 110.294 176.006 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 56.5 ttm -50.89 -57.52 8.29 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 122.994 0.518 . . . . 0.0 110.883 -178.158 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 31.6 mt -61.04 -38.33 79.31 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 CA-C-O 117.937 -1.03 . . . . 0.0 110.91 -172.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.382 0.0 OUTLIER -97.05 7.65 46.19 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 115.229 1.566 . . . . 0.0 115.229 176.704 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -122.99 87.71 2.8 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 119.596 1.089 . . . . 0.0 109.883 169.229 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -38.48 -42.39 0.75 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 126.041 1.737 . . . . 0.0 113.796 176.173 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -45.93 -46.32 16.04 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.385 0.674 . . . . 0.0 111.625 176.571 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 91.6 mt . . . . . 0 CA--C 1.534 0.344 0 C-N-CA 123.618 0.767 . . . . 0.0 112.97 -177.567 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 0.175 0 CA-C-O 121.174 0.511 . . . . 0.0 110.112 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.4 m -56.17 164.17 1.99 Allowed Pre-proline 0 CA--C 1.54 0.558 0 C-N-CA 124.256 1.023 . . . . 0.0 111.339 174.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo -47.56 -50.52 11.29 Favored 'Trans proline' 0 N--CA 1.458 -0.602 0 C-N-CA 123.013 2.475 . . . . 0.0 112.72 177.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' B' ' 5' ' ' LEU . 1.7 mt -60.52 -39.68 88.66 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-O 118.887 -0.578 . . . . 0.0 112.423 174.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -61.11 -45.88 92.86 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 119.291 0.951 . . . . 0.0 109.152 -179.304 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.9 tp60 -63.81 -43.92 94.81 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.717 -0.22 . . . . 0.0 111.081 177.106 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.31 -46.76 75.8 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.741 -0.599 . . . . 0.0 111.408 -177.42 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 76.7 mt -55.3 -52.16 48.53 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 170.268 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -45.19 -47.33 10.56 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 124.897 1.237 . . . . 0.0 111.906 174.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.5 mt -56.36 -59.01 5.58 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.442 0.697 . . . . 0.0 110.518 173.654 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.6 mp -57.25 -42.35 81.37 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 119.496 1.044 . . . . 0.0 112.061 -177.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 55.9 mt -58.77 -56.82 14.23 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 123.953 0.901 . . . . 0.0 110.439 174.168 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.06 -49.14 69.06 Favored Glycine 0 CA--C 1.522 0.513 0 N-CA-C 110.193 -1.163 . . . . 0.0 110.193 -176.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 8.5 mm -50.48 -53.51 12.26 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 C-N-CA 124.393 1.077 . . . . 0.0 109.99 174.138 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -52.64 -62.98 1.3 Allowed 'General case' 0 CA--C 1.528 0.117 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 177.079 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -51.03 -39.52 56.08 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.92 0.888 . . . . 0.0 111.745 -175.066 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -52.22 -34.82 47.38 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.969 0.907 . . . . 0.0 111.982 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 94.6 m-85 -111.42 -35.61 5.77 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 118.3 0.5 . . . . 0.0 112.18 -177.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.6 m . . . . . 0 CA--C 1.532 0.257 0 CA-C-N 119.028 0.831 . . . . 0.0 111.003 174.701 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 38.8 p-80 . . . . . 0 CA--C 1.538 0.493 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 17.0 p -135.72 171.93 13.75 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 126.79 2.036 . . . . 0.0 106.352 174.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.91 168.58 24.33 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 118.756 0.707 . . . . 0.0 110.485 173.836 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.4 t -116.25 -178.57 3.44 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.341 1.056 . . . . 0.0 112.256 -175.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 55.0 mttm -35.68 -66.61 0.19 Allowed 'General case' 0 C--O 1.234 0.285 0 C-N-CA 128.312 2.645 . . . . 0.0 113.235 -169.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 22.5 ttpp -50.82 -43.43 58.95 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.304 1.042 . . . . 0.0 110.589 -174.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -64.68 -35.61 81.6 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-O 118.723 -0.656 . . . . 0.0 111.602 -177.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -68.79 -51.38 41.57 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 119.502 1.047 . . . . 0.0 109.43 176.063 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -57.52 -42.35 82.68 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 120.996 0.427 . . . . 0.0 109.965 -178.482 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 55.9 tt0 -55.88 -65.66 0.56 Allowed 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 123.998 0.919 . . . . 0.0 109.233 169.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 4.9 mt -37.66 -60.65 0.69 Allowed 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 124.864 1.265 . . . . 0.0 112.003 179.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 18.3 tt -61.12 -48.53 88.59 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 -176.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 -56.5 -50.47 71.69 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.807 0.73 . . . . 0.0 112.063 179.284 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -70.35 -50.98 33.36 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.231 0.612 . . . . 0.0 110.695 -174.123 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -96.38 -17.83 20.36 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 -167.309 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 45.3 mt . . . . . 0 CA--C 1.526 0.039 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 169.883 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 . . . . . 0 C--O 1.225 -0.227 0 N-CA-C 113.511 0.93 . . . . 0.0 113.511 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.93 -60.24 0.17 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 126.108 1.763 . . . . 0.0 113.909 -179.317 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -63.57 -44.19 94.82 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.553 0.741 . . . . 0.0 110.843 -174.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 53' ' ' ILE . . . . . 0.636 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.4 mp -62.06 -52.38 61.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 -177.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 75.6 t -53.86 -53.6 25.85 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 C-N-CA 123.961 0.905 . . . . 0.0 109.319 177.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -47.28 -52.5 16.01 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 118.698 0.681 . . . . 0.0 111.81 178.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 16.7 mt -50.57 -39.32 49.18 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 119.269 -0.396 . . . . 0.0 111.923 178.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 8.7 mmt -81.0 -64.72 1.13 Allowed 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 118.458 0.572 . . . . 0.0 109.737 178.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -34.82 -43.8 0.2 Allowed 'General case' 0 CA--C 1.523 -0.067 0 C-N-CA 128.046 2.538 . . . . 0.0 112.069 178.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -37.41 -50.95 1.1 Allowed 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.61 1.164 . . . . 0.0 112.577 176.067 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.8 pp -60.49 -33.13 72.16 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -173.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -83.54 -45.65 13.32 Favored 'General case' 0 N--CA 1.456 -0.125 0 C-N-CA 123.516 0.727 . . . . 0.0 109.746 176.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 52.8 ttt-85 -58.16 -37.14 74.11 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 122.178 -0.326 . . . . 0.0 110.955 -176.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 . . . . . 0 CA--C 1.537 0.458 0 O-C-N 121.478 -0.764 . . . . 0.0 112.357 177.766 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 . . . . . 0 N--CA 1.452 -0.351 0 N-CA-C 107.642 -1.244 . . . . 0.0 107.642 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 28.4 m -79.58 136.08 24.31 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 N-CA-C 107.829 -1.175 . . . . 0.0 107.829 169.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 1.1 p30 -80.65 171.47 14.98 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.774 0.321 . . . . 0.0 111.186 176.682 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 55.9 t80 -38.12 -61.92 0.62 Allowed 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.401 1.08 . . . . 0.0 112.97 174.023 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 10.2 tp-100 -63.98 -32.52 74.09 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 120.391 1.45 . . . . 0.0 111.694 -175.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -64.52 -41.72 96.21 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 119.623 1.101 . . . . 0.0 110.162 175.15 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -57.95 -48.67 79.26 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.794 -0.566 . . . . 0.0 109.796 171.572 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 19.7 mm -60.83 -27.77 41.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 O-C-N 121.532 -0.73 . . . . 0.0 110.745 176.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 42.5 m -73.34 -38.69 65.67 Favored 'General case' 0 C--O 1.226 -0.181 0 O-C-N 121.076 -1.015 . . . . 0.0 110.171 172.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 36.6 t80 -54.33 -54.76 36.01 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 171.175 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 32.8 mt -59.9 -47.65 84.88 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 177.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.69 -39.83 97.93 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 111.021 -0.831 . . . . 0.0 111.021 -174.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.69 -47.85 57.74 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 123.882 0.873 . . . . 0.0 110.22 176.674 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -47.58 -53.74 13.72 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 123.933 0.893 . . . . 0.0 109.565 173.034 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -55.12 -56.31 21.25 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 124.259 1.024 . . . . 0.0 110.365 174.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 51.5 ttm -50.55 -42.95 55.96 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.516 0.598 . . . . 0.0 111.763 -178.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 42.8 mt -67.88 -58.39 6.24 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.442 0 CA-C-O 118.385 -0.817 . . . . 0.0 110.644 -179.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.364 1.0 OUTLIER -77.42 -38.39 49.79 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 119.94 1.246 . . . . 0.0 113.385 -174.674 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -78.75 64.86 3.84 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 170.295 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 60.0 mt-10 -46.91 -31.29 3.03 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 125.702 1.601 . . . . 0.0 112.802 -174.082 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -45.48 -36.92 4.79 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.06 0.944 . . . . 0.0 112.767 175.041 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 83.8 mt . . . . . 0 CA--C 1.533 0.299 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 178.267 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.455 -0.192 0 CA-C-O 120.583 0.23 . . . . 0.0 111.214 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 2.7 m -54.51 161.71 1.99 Allowed Pre-proline 0 CA--C 1.538 0.518 0 C-N-CA 123.829 0.852 . . . . 0.0 111.193 173.213 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_exo -45.57 -49.08 11.08 Favored 'Trans proline' 0 N--CA 1.46 -0.453 0 C-N-CA 123.519 2.813 . . . . 0.0 113.573 -179.39 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.8 mt -55.62 -52.93 62.12 Favored 'General case' 0 C--O 1.226 -0.168 0 N-CA-C 111.769 0.285 . . . . 0.0 111.769 174.328 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -60.24 -41.44 93.14 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 -175.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.0 tp-100 -60.98 -51.08 70.76 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.57 0.748 . . . . 0.0 110.493 176.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.99 -45.81 93.31 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.338 0.655 . . . . 0.0 111.146 -178.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 67.2 mt -53.59 -52.16 36.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 170.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.69 -47.74 23.88 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 125.369 1.462 . . . . 0.0 111.601 175.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 mt -55.98 -54.59 42.96 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 117.726 0.763 . . . . 0.0 110.995 174.443 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.99 -43.93 91.53 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 118.87 0.759 . . . . 0.0 111.558 -179.299 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 96.2 mt -58.05 -49.29 81.9 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 123.007 0.523 . . . . 0.0 110.173 173.546 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.75 -51.54 54.4 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 110.102 -1.199 . . . . 0.0 110.102 -178.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 8.2 mm -54.81 -49.35 70.05 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 123.273 0.629 . . . . 0.0 109.745 175.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . 0.401 ' HB2' ' CE2' ' A' ' 73' ' ' TYR . 32.2 t80 -53.48 -55.67 23.36 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 121.479 0.657 . . . . 0.0 110.985 178.077 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 74.2 t60 -64.79 -32.39 74.05 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.346 -175.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -53.11 -49.65 66.07 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.882 0.764 . . . . 0.0 110.712 176.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -89.96 -36.04 15.21 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 122.323 -0.236 . . . . 0.0 111.321 -175.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.3 t . . . . . 0 CA--C 1.538 0.487 0 O-C-N 121.775 -0.578 . . . . 0.0 110.641 173.555 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.455 -0.206 0 N-CA-C 105.694 -1.965 . . . . 0.0 105.694 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -160.01 174.82 13.78 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 119.008 0.822 . . . . 0.0 110.661 -176.79 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 59.6 p -124.57 174.38 7.86 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 118.808 0.731 . . . . 0.0 112.579 -170.025 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -27.39 -53.47 0.08 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 128.348 2.659 . . . . 0.0 114.016 169.664 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.07 -54.77 40.98 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.805 0.842 . . . . 0.0 109.713 179.724 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 -66.11 -34.34 77.83 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 118.642 -0.694 . . . . 0.0 110.527 -177.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 60.2 mt -65.13 -50.06 67.51 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.317 0.962 . . . . 0.0 110.999 177.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 40.7 mttp -57.19 -49.16 76.83 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 174.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -53.09 -54.73 31.26 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.644 0.778 . . . . 0.0 110.302 177.006 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.6 mt -48.42 -65.29 0.59 Allowed 'General case' 0 CA--C 1.52 -0.196 0 C-N-CA 126.099 1.759 . . . . 0.0 110.171 177.4 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 16.9 tt -59.89 -44.76 95.03 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.275 0 N-CA-C 109.543 -0.539 . . . . 0.0 109.543 -171.442 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -60.16 -53.51 56.93 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 179.364 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -67.82 -49.19 63.58 Favored 'General case' 0 C--O 1.227 -0.083 0 O-C-N 121.825 -0.547 . . . . 0.0 109.576 -174.133 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -74.63 -65.05 0.91 Allowed 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -175.767 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 89.3 mt . . . . . 0 N--CA 1.455 -0.2 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 -178.068 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 . . . . . 0 CA--C 1.531 0.213 0 N-CA-C 114.773 1.398 . . . . 0.0 114.773 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.86 -59.56 0.17 Allowed 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.796 1.639 . . . . 0.0 114.66 -178.237 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 17.6 tt0 -65.57 -40.27 92.58 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-O 121.13 0.491 . . . . 0.0 111.214 -174.265 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.643 HD12 ' H ' ' A' ' 53' ' ' ILE . 2.2 mp -63.83 -51.86 64.36 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 69.2 t -55.13 -43.7 71.34 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 C-N-CA 124.401 1.081 . . . . 0.0 110.348 178.466 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.34 -54.41 45.78 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 119.205 0.911 . . . . 0.0 110.454 173.89 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 57.5 mt -54.18 -40.02 67.15 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 119.267 -0.397 . . . . 0.0 111.2 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 25.3 mmt -68.62 -65.01 0.75 Allowed 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.549 0.613 . . . . 0.0 109.711 175.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -40.69 -40.46 1.31 Allowed 'General case' 0 N--CA 1.462 0.171 0 C-N-CA 128.077 2.551 . . . . 0.0 111.886 -177.572 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -38.43 -48.55 1.38 Allowed 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 124.479 1.112 . . . . 0.0 111.876 175.284 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -61.33 -38.29 86.37 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 118.393 0.542 . . . . 0.0 111.838 -176.551 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -76.15 -51.19 12.68 Favored 'General case' 0 N--CA 1.457 -0.106 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 16.9 ttm180 . . . . . 0 N--CA 1.455 -0.208 0 C-N-CA 123.571 0.748 . . . . 0.0 109.926 177.215 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 . . . . . 0 CA--C 1.53 0.186 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.4 m -137.38 149.65 25.79 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 C-N-CA 126.044 1.738 . . . . 0.0 108.079 174.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -89.49 175.71 7.19 Favored 'General case' 0 C--N 1.339 0.142 0 C-N-CA 124.285 1.034 . . . . 0.0 111.108 176.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -39.46 -64.74 0.44 Allowed 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 125.275 1.43 . . . . 0.0 112.967 174.483 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 11.0 tp-100 -65.03 -32.22 73.83 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 120.242 1.383 . . . . 0.0 111.807 -172.578 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -65.22 -44.47 88.15 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 119.033 0.833 . . . . 0.0 110.419 175.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . 0.401 ' CE2' ' HB2' ' A' ' 16' ' ' PHE . 0.7 OUTLIER -55.92 -54.31 46.28 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 172.279 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 20.7 mm -52.06 -46.37 42.63 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.312 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 178.419 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 92.9 m -59.35 -27.8 66.26 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 123.464 0.706 . . . . 0.0 111.795 179.084 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 11.4 t80 -59.69 -52.13 66.84 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 119.464 1.029 . . . . 0.0 108.436 172.166 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 56.2 mt -67.26 -40.05 86.15 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.853 0.861 . . . . 0.0 111.699 -179.538 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.51 -45.12 69.38 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.135 -1.186 . . . . 0.0 110.135 -178.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.02 -48.58 81.13 Favored 'General case' 0 N--CA 1.451 -0.387 0 O-C-N 122.279 -0.541 . . . . 0.0 109.796 173.246 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 22.5 tp -50.44 -57.03 8.97 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.407 0.622 . . . . 0.0 109.807 176.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.1 -55.04 16.57 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 124.56 1.144 . . . . 0.0 110.247 177.294 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 7.7 ttp -59.82 -45.07 93.53 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 122.925 0.49 . . . . 0.0 111.516 -175.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 93.0 mt -64.63 -52.94 48.4 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 CA-C-O 117.995 -1.002 . . . . 0.0 110.281 -177.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.445 0.0 OUTLIER -79.3 -34.06 42.73 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 120.034 1.288 . . . . 0.0 113.887 -176.121 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -80.1 72.93 6.92 Favored 'General case' 0 N--CA 1.462 0.164 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 169.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -47.79 -30.48 4.01 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.956 1.302 . . . . 0.0 113.097 -171.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -38.79 -47.02 1.34 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.959 1.304 . . . . 0.0 112.39 169.817 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.4 mt . . . . . 0 CA--C 1.534 0.343 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -177.241 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.532 0.277 0 CA-C-O 121.249 0.547 . . . . 0.0 110.378 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 2.5 m -59.63 166.41 3.33 Favored Pre-proline 0 CA--C 1.539 0.549 0 C-N-CA 125.134 1.374 . . . . 0.0 111.202 178.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_exo -45.75 -47.26 14.05 Favored 'Trans proline' 0 N--CA 1.459 -0.5 0 C-N-CA 123.257 2.638 . . . . 0.0 112.927 177.652 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.428 HD23 ' HA ' ' B' ' 5' ' ' LEU . 6.2 mt -56.67 -49.23 75.69 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 119.329 -0.367 . . . . 0.0 111.514 174.249 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -58.21 -46.74 85.31 Favored 'General case' 0 N--CA 1.457 -0.124 0 CA-C-N 118.488 0.585 . . . . 0.0 109.853 -178.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 -57.54 -51.0 71.25 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 122.759 0.424 . . . . 0.0 110.575 177.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.5 -45.7 82.55 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.49 0.716 . . . . 0.0 111.867 -175.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 81.7 mt -55.88 -50.08 70.97 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 172.002 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.37 -50.39 17.84 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 124.886 1.231 . . . . 0.0 111.5 173.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.1 mt -54.24 -57.59 10.59 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 117.474 0.637 . . . . 0.0 110.702 174.223 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 9.9 mp -57.42 -43.44 83.82 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 119.391 0.996 . . . . 0.0 112.032 -177.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 85.8 mt -56.97 -58.03 7.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 C-N-CA 123.171 0.588 . . . . 0.0 110.12 173.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.25 -49.5 67.86 Favored Glycine 0 CA--C 1.524 0.605 0 N-CA-C 110.553 -1.019 . . . . 0.0 110.553 -175.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.3 mm -49.68 -50.99 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 C-N-CA 124.139 0.976 . . . . 0.0 109.935 173.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 56.4 t80 -57.46 -58.94 6.1 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 121.042 0.449 . . . . 0.0 110.008 178.05 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 7.1 t-80 -51.55 -36.98 47.43 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.051 0.94 . . . . 0.0 111.626 -176.513 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -51.56 -34.04 34.97 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.298 1.039 . . . . 0.0 112.474 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -111.61 -47.41 3.16 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 118.6 0.636 . . . . 0.0 110.688 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 N--CA 1.455 -0.203 0 C-N-CA 123.266 0.626 . . . . 0.0 111.963 -176.398 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.539 0.536 0 N-CA-C 114.109 1.152 . . . . 0.0 114.109 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -138.85 151.91 47.38 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.078 1.351 . . . . 0.0 109.474 -170.201 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -156.09 166.38 33.62 Favored 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 123.26 0.624 . . . . 0.0 110.779 174.031 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 67.9 m -111.76 174.68 5.76 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.145 1.378 . . . . 0.0 112.818 -176.197 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -37.81 -55.38 1.19 Allowed 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 126.913 2.085 . . . . 0.0 114.545 -177.683 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -53.56 -48.51 69.08 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 -176.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -61.14 -38.65 87.16 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 123.041 0.536 . . . . 0.0 111.324 179.133 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 85.0 mt -63.27 -49.33 74.48 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 119.214 0.916 . . . . 0.0 111.038 175.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -57.56 -47.17 82.79 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 177.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -58.17 -47.41 83.49 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-O 119.024 -0.512 . . . . 0.0 110.791 175.232 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 8.9 mt -50.76 -53.58 30.56 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 119.655 1.116 . . . . 0.0 110.176 178.242 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 35.9 mt -56.78 -60.34 2.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.212 175.558 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 21.1 tt0 -53.07 -48.98 67.3 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.621 -0.674 . . . . 0.0 112.496 -173.476 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 9.5 mmpt? -79.53 -48.97 12.96 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 125.564 1.546 . . . . 0.0 110.551 -171.178 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 28.2 mm-40 -101.89 -12.42 18.26 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 -168.435 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 57.2 mt . . . . . 0 C--O 1.231 0.102 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 169.559 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 18.3 p-10 . . . . . 0 N--CA 1.463 0.189 0 N-CA-C 110.282 -0.266 . . . . 0.0 110.282 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.84 -63.57 0.13 Allowed 'General case' 0 C--O 1.226 -0.142 0 C-N-CA 126.198 1.799 . . . . 0.0 114.133 -174.242 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -66.17 -37.54 85.89 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 122.747 0.419 . . . . 0.0 111.32 -172.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 53' ' ' ILE . . . . . 0.634 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.4 mp -62.28 -52.76 56.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 N-CA-C 106.076 -1.824 . . . . 0.0 106.076 177.841 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 71.9 t -54.04 -40.87 47.68 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 C-N-CA 124.23 1.012 . . . . 0.0 110.41 176.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 12.8 mmmt -60.94 -51.22 70.21 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 120.187 1.358 . . . . 0.0 110.484 175.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 76.3 mt -56.96 -36.41 70.26 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 119.148 -0.454 . . . . 0.0 110.906 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 25.2 mmt -70.26 -62.49 1.37 Allowed 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 118.739 0.699 . . . . 0.0 109.808 173.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -46.61 -30.47 2.31 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 128.132 2.573 . . . . 0.0 112.405 -176.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -38.29 -48.17 1.28 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.508 1.123 . . . . 0.0 111.268 169.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.9 pp -58.52 -34.32 70.83 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 121.144 -0.972 . . . . 0.0 112.167 -178.764 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -78.42 -55.95 4.82 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 178.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 16.5 mmt180 -42.11 -50.35 4.75 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 124.972 1.309 . . . . 0.0 110.646 176.371 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 25.5 m120 . . . . . 0 N--CA 1.449 -0.485 0 C-N-CA 123.971 0.908 . . . . 0.0 111.849 -171.456 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 . . . . . 0 N--CA 1.452 -0.348 0 CA-C-O 120.643 0.259 . . . . 0.0 111.309 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 34.9 m -132.58 147.6 31.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 N-CA-C 105.618 -1.993 . . . . 0.0 105.618 165.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 20.2 p30 -89.24 171.6 9.67 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 123.556 0.742 . . . . 0.0 110.884 176.746 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -39.97 -60.85 0.95 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.568 1.147 . . . . 0.0 113.16 175.186 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -64.56 -35.99 82.78 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 120.314 1.416 . . . . 0.0 111.362 -174.167 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.77 -40.27 96.27 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.561 -0.712 . . . . 0.0 110.578 175.194 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -57.2 -49.68 75.25 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 118.571 0.623 . . . . 0.0 109.964 169.653 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 24.6 mm -58.62 -28.14 36.05 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 O-C-N 121.384 -0.822 . . . . 0.0 110.709 176.779 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 30.1 m -80.25 -23.48 40.79 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.231 1.012 . . . . 0.0 111.786 173.366 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -67.56 -53.48 28.0 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 107.673 -1.232 . . . . 0.0 107.673 169.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 40.9 mt -57.65 -41.65 81.91 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 120.908 0.385 . . . . 0.0 110.668 171.661 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.76 -53.1 46.53 Favored Glycine 0 CA--C 1.523 0.577 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 179.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.75 -47.31 85.8 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 122.83 0.452 . . . . 0.0 110.641 178.218 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 11.3 tp -48.06 -60.54 2.54 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.978 0.894 . . . . 0.0 110.082 175.155 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.85 -56.64 12.78 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 125.31 1.444 . . . . 0.0 110.294 -179.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 56.6 ttm -56.26 -43.42 78.71 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.737 0.815 . . . . 0.0 110.989 -178.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 96.4 mt -67.9 -55.74 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-O 118.415 -0.802 . . . . 0.0 109.533 -175.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.4 0.4 OUTLIER -73.13 -33.63 65.64 Favored 'General case' 0 C--N 1.344 0.356 0 C-N-CA 118.325 -1.35 . . . . 0.0 112.803 -175.982 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -81.14 64.98 6.1 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 169.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -42.22 -37.96 1.63 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.138 1.375 . . . . 0.0 112.747 -176.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.69 -54.0 0.44 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 126.093 1.757 . . . . 0.0 112.65 169.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 61.7 mt . . . . . 0 CA--C 1.532 0.284 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -173.285 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.529 0.137 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.4 m -56.01 163.79 2.07 Favored Pre-proline 0 CA--C 1.54 0.593 0 C-N-CA 124.204 1.002 . . . . 0.0 111.352 177.049 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -46.62 -49.02 12.71 Favored 'Trans proline' 0 N--CA 1.459 -0.528 0 C-N-CA 123.255 2.637 . . . . 0.0 112.831 178.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.2 mt -58.64 -46.39 87.22 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-O 119.193 -0.432 . . . . 0.0 111.543 175.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -56.97 -48.18 79.0 Favored 'General case' 0 C--O 1.227 -0.131 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 -179.025 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.3 tp60 -62.81 -44.44 96.14 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.275 179.146 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.4 -46.17 81.08 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 121.355 0.598 . . . . 0.0 111.328 -178.181 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 72.4 mt -54.55 -50.86 55.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 170.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.51 -48.98 16.48 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 124.646 1.117 . . . . 0.0 111.729 173.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 mt -55.36 -55.34 32.71 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 117.767 0.784 . . . . 0.0 110.945 174.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -58.91 -45.2 90.9 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 119.012 0.824 . . . . 0.0 111.839 -178.04 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.415 HD11 ' HB1' ' B' ' 81' ' ' ALA . 90.5 mt -59.5 -50.98 77.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 C-N-CA 122.857 0.463 . . . . 0.0 110.354 175.073 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -53.59 -54.07 32.3 Favored Glycine 0 CA--C 1.523 0.539 0 N-CA-C 109.763 -1.335 . . . . 0.0 109.763 -179.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 6.8 mm -50.53 -51.7 18.24 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 C-N-CA 124.079 0.952 . . . . 0.0 110.12 174.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -51.51 -57.25 9.57 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 118.022 0.374 . . . . 0.0 110.594 178.454 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -70.3 -21.7 62.91 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 -174.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.8 ttpp -57.93 -18.57 24.09 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 119.034 -0.508 . . . . 0.0 111.342 169.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -115.92 -67.72 0.97 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.743 0.817 . . . . 0.0 110.273 171.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 30.9 p . . . . . 0 N--CA 1.469 0.476 0 CA-C-O 121.714 0.769 . . . . 0.0 111.158 -173.997 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.3 p . . . . . 0 N--CA 1.449 -0.478 0 N-CA-C 109.585 -0.524 . . . . 0.0 109.585 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.7 pp -160.2 -173.86 4.24 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 169.384 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 77.8 p -129.95 172.84 11.28 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 119.697 1.135 . . . . 0.0 112.568 -179.582 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.7 ptmm? -31.69 -51.06 0.21 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 126.107 1.763 . . . . 0.0 113.512 169.491 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.7 ttpt -60.87 -47.53 85.98 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -177.241 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.0 mp0 -66.55 -35.44 80.23 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 118.428 -0.796 . . . . 0.0 110.559 179.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 73.7 mt -61.52 -51.38 68.85 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.779 1.172 . . . . 0.0 111.032 174.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.0 mtpp -60.11 -45.12 94.03 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 120.841 0.353 . . . . 0.0 110.279 179.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -54.52 -54.93 34.58 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.112 0.965 . . . . 0.0 110.521 173.661 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.0 mt -49.02 -61.19 2.2 Favored 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 125.382 1.473 . . . . 0.0 110.033 178.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 20.2 tt -59.71 -48.74 86.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 C-N-CA 119.872 -0.731 . . . . 0.0 109.724 -176.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 -54.88 -50.11 69.54 Favored 'General case' 0 CA--C 1.539 0.528 0 O-C-N 121.88 -0.512 . . . . 0.0 112.208 -178.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.7 -54.21 7.32 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 121.908 -0.495 . . . . 0.0 110.714 -176.862 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 49.8 mm-40 -82.4 -21.81 35.64 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 -167.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 23.0 mt . . . . . 0 C--O 1.227 -0.086 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 174.437 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 . . . . . 0 N--CA 1.462 0.135 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.37 -60.91 0.14 Allowed 'General case' 0 C--O 1.226 -0.177 0 C-N-CA 125.874 1.67 . . . . 0.0 113.313 -176.331 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -64.56 -38.09 89.82 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -173.316 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.479 HD12 ' H ' ' A' ' 53' ' ' ILE . 1.2 mp -61.64 -54.97 27.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 N-CA-C 106.159 -1.793 . . . . 0.0 106.159 176.519 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 79.1 t -51.49 -49.62 32.22 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.079 -178.298 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 6.4 mmmm -51.86 -47.61 64.37 Favored 'General case' 0 C--N 1.339 0.111 0 CA-C-N 119.59 1.086 . . . . 0.0 111.753 -176.567 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 32.9 mt -57.33 -35.61 70.1 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 119.283 -0.389 . . . . 0.0 111.543 -178.011 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.28 -62.87 1.55 Allowed 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 176.128 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -40.57 -40.36 1.24 Allowed 'General case' 0 CA--C 1.523 -0.094 0 C-N-CA 127.528 2.331 . . . . 0.0 111.877 -179.351 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -38.52 -47.57 1.3 Allowed 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.811 1.244 . . . . 0.0 112.009 175.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -57.6 -51.89 67.65 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 118.124 0.42 . . . . 0.0 110.713 -178.44 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -74.44 -31.38 62.26 Favored 'General case' 0 C--O 1.224 -0.262 0 C-N-CA 123.231 0.613 . . . . 0.0 111.383 -176.215 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.5 ttm180 . . . . . 0 N--CA 1.452 -0.369 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 173.315 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 . . . . . 0 CA--C 1.533 0.315 0 CA-C-O 120.822 0.344 . . . . 0.0 110.735 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 4.2 m -143.93 159.79 16.03 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 127.218 2.207 . . . . 0.0 107.87 174.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -101.04 170.92 7.95 Favored 'General case' 0 N--CA 1.462 0.157 0 C-N-CA 125.086 1.354 . . . . 0.0 110.964 175.812 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 73.9 t80 -35.12 -63.42 0.33 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.685 1.194 . . . . 0.0 112.945 171.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 28.9 tp60 -67.03 -29.04 68.74 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 119.633 1.106 . . . . 0.0 111.81 -171.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -65.72 -43.23 89.73 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.14 -0.975 . . . . 0.0 109.845 172.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -54.43 -49.29 70.33 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.985 -0.447 . . . . 0.0 109.91 170.611 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.8 mm -58.72 -33.53 49.29 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 O-C-N 121.6 -0.688 . . . . 0.0 110.732 175.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 32.3 m -70.52 -30.27 66.99 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.07 -1.019 . . . . 0.0 111.04 174.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -61.03 -55.45 32.65 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 121.096 -1.003 . . . . 0.0 109.169 170.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 44.3 mt -62.36 -40.25 95.8 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.118 0.485 . . . . 0.0 111.535 179.19 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.35 -43.69 96.49 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 110.643 -0.983 . . . . 0.0 110.643 179.617 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.39 -47.8 80.5 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 117.497 0.648 . . . . 0.0 110.444 175.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 20.3 tp -48.61 -58.98 3.89 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 121.402 0.62 . . . . 0.0 110.257 172.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . 0.516 ' HB1' HD11 ' B' ' 13' ' ' ILE . . . -49.77 -54.18 20.58 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 124.381 1.073 . . . . 0.0 110.496 179.328 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 46.9 ttm -57.84 -49.78 75.51 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 123.809 0.844 . . . . 0.0 111.091 -178.316 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 67.0 mt -63.35 -49.56 82.37 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 CA-C-O 117.942 -1.028 . . . . 0.0 109.932 -174.13 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.451 0.1 OUTLIER -79.46 -37.66 36.4 Favored 'General case' 0 C--N 1.347 0.488 0 CA-C-N 119.733 1.151 . . . . 0.0 113.837 -178.258 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -80.72 75.12 7.64 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 107.691 -1.225 . . . . 0.0 107.691 171.043 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -47.66 -32.45 5.67 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.627 1.171 . . . . 0.0 112.684 -175.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -40.87 -38.87 1.02 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.673 1.189 . . . . 0.0 113.171 171.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 43.7 mt . . . . . 0 CA--C 1.537 0.462 0 C-N-CA 124.939 1.296 . . . . 0.0 113.828 -173.828 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.247 0 CA-C-O 120.902 0.382 . . . . 0.0 110.101 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -53.83 159.99 2.38 Favored Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 124.622 1.169 . . . . 0.0 111.248 176.74 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -47.52 -49.62 12.94 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 123.305 2.67 . . . . 0.0 112.806 179.801 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.43 HD23 ' HA ' ' B' ' 5' ' ' LEU . 5.2 mt -58.41 -43.88 88.79 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 119.094 -0.479 . . . . 0.0 111.788 174.873 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -62.86 -42.06 99.61 Favored 'General case' 0 C--O 1.226 -0.143 0 CA-C-N 119.045 0.838 . . . . 0.0 109.489 -177.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 12.8 tp60 -61.69 -46.75 88.37 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 122.39 0.276 . . . . 0.0 110.853 175.109 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.28 -46.8 82.09 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.645 0.736 . . . . 0.0 111.275 -177.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 74.8 mt -55.74 -50.92 64.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 171.492 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -48.49 -45.89 29.43 Favored Glycine 0 CA--C 1.527 0.787 0 C-N-CA 125.031 1.301 . . . . 0.0 111.468 175.372 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.8 mt -56.27 -57.45 12.18 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 117.613 0.707 . . . . 0.0 110.409 173.284 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -57.12 -43.4 82.32 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 119.371 0.987 . . . . 0.0 112.122 -178.225 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . 0.516 HD11 ' HB1' ' A' ' 81' ' ' ALA . 97.2 mt -61.2 -54.08 40.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 123.151 0.58 . . . . 0.0 110.679 175.495 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.99 -51.23 55.16 Favored Glycine 0 CA--C 1.522 0.494 0 N-CA-C 109.666 -1.374 . . . . 0.0 109.666 -177.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 8.5 mm -48.04 -54.7 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 C-N-CA 124.279 1.032 . . . . 0.0 110.277 173.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -53.29 -62.15 1.84 Allowed 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 121.347 0.594 . . . . 0.0 110.257 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 54.7 t60 -72.63 -12.91 61.24 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 118.971 -0.538 . . . . 0.0 112.393 -170.812 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -54.96 -44.48 74.4 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.423 1.01 . . . . 0.0 108.778 169.093 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -94.15 73.07 3.99 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 104.9 -2.259 . . . . 0.0 104.9 171.122 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 85.1 p . . . . . 0 CA--C 1.531 0.225 0 C-N-CA 127.227 2.211 . . . . 0.0 114.376 -167.678 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 6.4 p-80 . . . . . 0 CA--C 1.54 0.578 0 N-CA-C 111.58 0.215 . . . . 0.0 111.58 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 71.6 p -134.43 145.03 48.5 Favored 'General case' 0 C--O 1.227 -0.089 0 C-N-CA 124.921 1.288 . . . . 0.0 108.246 175.643 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -156.57 163.03 39.84 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-N 119.323 0.965 . . . . 0.0 110.69 -178.092 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 29.9 t -120.99 -168.65 1.7 Allowed 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.635 0.731 . . . . 0.0 110.944 -176.197 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 10.3 pttm -46.99 -50.98 18.22 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 126.893 2.077 . . . . 0.0 113.131 -171.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -55.48 -52.13 64.66 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 120.762 0.315 . . . . 0.0 110.294 -179.132 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -67.04 -35.66 80.37 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 118.436 -0.792 . . . . 0.0 111.8 -179.456 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 30.0 mt -64.03 -52.3 60.14 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 119.966 1.257 . . . . 0.0 111.149 175.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 90.4 mttt -56.38 -43.83 79.6 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 122.707 0.403 . . . . 0.0 110.044 177.317 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 65.7 tt0 -54.09 -66.45 0.39 Allowed 'General case' 0 C--O 1.223 -0.334 0 CA-C-O 118.895 -0.574 . . . . 0.0 109.523 171.448 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 3.8 mt -37.54 -60.09 0.72 Allowed 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 125.364 1.465 . . . . 0.0 111.565 179.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 14.3 tt -62.55 -45.2 99.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.265 -176.094 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 -57.34 -52.96 63.22 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 121.343 -0.848 . . . . 0.0 111.731 177.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 11.4 mmpt? -66.76 -49.29 66.4 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.059 0.544 . . . . 0.0 110.497 -174.562 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 70.1 mm-40 -98.06 -16.65 19.51 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 115.06 1.504 . . . . 0.0 115.06 -166.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 13.5 mt . . . . . 0 CA--C 1.523 -0.088 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 171.894 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 . . . . . 0 C--O 1.225 -0.222 0 N-CA-C 114.364 1.246 . . . . 0.0 114.364 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.64 -56.25 0.16 Allowed 'General case' 0 CA--C 1.527 0.092 0 C-N-CA 126.118 1.767 . . . . 0.0 114.455 -177.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -67.45 -39.54 85.37 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 120.912 0.387 . . . . 0.0 111.148 -174.436 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 53' ' ' ILE . . . . . 0.56 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.5 mp -61.68 -51.4 73.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 176.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 76.9 t -57.34 -42.4 80.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 C-N-CA 123.938 0.895 . . . . 0.0 110.475 -179.417 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.76 -55.21 37.79 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 119.433 1.015 . . . . 0.0 110.443 173.089 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 49.0 mt -53.35 -37.96 62.84 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 122.489 0.316 . . . . 0.0 111.544 -179.55 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.72 -65.56 0.81 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.236 0.471 . . . . 0.0 109.961 175.721 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -40.32 -39.88 1.05 Allowed 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 127.489 2.316 . . . . 0.0 111.991 -177.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -37.04 -51.34 0.94 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.172 1.389 . . . . 0.0 111.816 172.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -58.75 -35.64 73.05 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 121.43 -0.794 . . . . 0.0 112.232 -176.591 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -80.75 -49.57 10.98 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 123.141 0.577 . . . . 0.0 109.629 179.385 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 14.8 ttm180 -50.89 -46.72 60.64 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.617 0.767 . . . . 0.0 110.164 178.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 34.6 m120 . . . . . 0 N--CA 1.455 -0.214 0 C-N-CA 123.257 0.623 . . . . 0.0 112.37 -179.104 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 50.0 mm-40 . . . . . 0 N--CA 1.45 -0.473 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 32.7 m -87.13 148.52 4.56 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 N-CA-C 107.483 -1.302 . . . . 0.0 107.483 167.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 15.5 p-10 -91.18 -176.68 4.66 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 123.94 0.896 . . . . 0.0 111.403 177.341 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -49.84 -62.09 1.76 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.853 0.861 . . . . 0.0 112.293 177.256 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 41.1 tp60 -60.4 -37.25 80.23 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 119.299 0.954 . . . . 0.0 111.17 -174.064 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -62.66 -46.07 89.9 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.711 -0.618 . . . . 0.0 110.705 175.753 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -55.15 -49.81 70.89 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.846 -0.534 . . . . 0.0 110.148 171.59 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 26.8 mm -56.98 -28.48 28.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 O-C-N 121.799 -0.563 . . . . 0.0 110.464 175.425 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 27.8 m -80.96 -24.48 38.07 Favored 'General case' 0 CA--C 1.529 0.171 0 O-C-N 121.301 -0.874 . . . . 0.0 112.986 173.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -62.9 -52.74 61.9 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 107.117 -1.438 . . . . 0.0 107.117 167.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 48.9 mt -62.22 -40.9 97.65 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 120.888 0.375 . . . . 0.0 111.726 175.295 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -60.82 -49.53 77.58 Favored Glycine 0 CA--C 1.521 0.428 0 N-CA-C 110.53 -1.028 . . . . 0.0 110.53 -179.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.49 -47.44 85.66 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.155 0.582 . . . . 0.0 110.026 175.801 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 19.5 tp -49.59 -57.22 7.54 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.455 0.645 . . . . 0.0 109.853 175.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . 0.415 ' HB1' HD11 ' A' ' 13' ' ' ILE . . . -51.64 -56.47 13.41 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 124.71 1.204 . . . . 0.0 110.55 178.724 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 55.5 ttm -54.56 -46.97 73.75 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.172 0.989 . . . . 0.0 111.177 -178.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.1 mt -66.52 -52.86 41.57 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.301 0 CA-C-O 117.922 -1.037 . . . . 0.0 110.399 -175.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.436 0.0 OUTLIER -80.46 -33.59 36.59 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 120.027 1.285 . . . . 0.0 114.141 -176.611 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 22.6 m-80 -81.33 70.03 8.09 Favored 'General case' 0 CA--C 1.523 -0.088 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 170.166 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -42.82 -38.25 2.08 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 126.024 1.73 . . . . 0.0 111.699 -176.134 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -34.02 -47.68 0.28 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 126.551 1.94 . . . . 0.0 113.343 170.62 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 64.5 mt . . . . . 0 CA--C 1.531 0.23 0 C-N-CA 123.126 0.571 . . . . 0.0 112.443 -177.382 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.223 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.1 m -51.84 158.19 1.75 Allowed Pre-proline 0 CA--C 1.54 0.558 0 C-N-CA 124.149 0.98 . . . . 0.0 110.802 171.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -48.47 -48.9 15.81 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 122.944 2.429 . . . . 0.0 112.752 -179.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.9 mt -59.95 -44.91 94.11 Favored 'General case' 0 C--O 1.224 -0.251 0 CA-C-O 119.299 -0.381 . . . . 0.0 111.328 175.522 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -58.89 -46.82 86.94 Favored 'General case' 0 CA--C 1.528 0.12 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 -178.143 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -57.68 -52.4 65.58 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.383 0.673 . . . . 0.0 110.743 175.76 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.95 -46.2 88.88 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.407 0.622 . . . . 0.0 111.783 -175.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 71.2 mt -54.65 -51.88 46.69 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 171.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.55 -48.31 17.06 Favored Glycine 0 CA--C 1.527 0.814 0 C-N-CA 124.725 1.155 . . . . 0.0 111.804 174.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 mt -55.74 -56.42 20.65 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 117.613 0.706 . . . . 0.0 111.078 174.365 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 mp -58.3 -44.15 88.43 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 118.979 0.809 . . . . 0.0 111.696 -178.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 83.3 mt -55.81 -55.14 19.43 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.185 0 C-N-CA 123.316 0.646 . . . . 0.0 109.975 173.283 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.06 -50.03 56.89 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 110.541 -1.024 . . . . 0.0 110.541 -177.563 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 11.7 mm -53.03 -49.2 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 C-N-CA 123.371 0.668 . . . . 0.0 110.271 175.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -56.4 -62.96 1.36 Allowed 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 121.293 0.568 . . . . 0.0 109.622 177.05 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -51.82 -39.68 59.19 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.8 1.24 . . . . 0.0 111.689 -174.049 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.5 tttp -48.97 -39.42 26.49 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.079 0.951 . . . . 0.0 111.441 178.01 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -100.01 -59.85 1.64 Allowed 'General case' 0 C--O 1.234 0.261 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.6 m . . . . . 0 N--CA 1.453 -0.281 0 C-N-CA 124.049 0.94 . . . . 0.0 111.117 -175.662 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 60.3 p . . . . . 0 CA--C 1.538 0.484 0 N-CA-C 112.721 0.637 . . . . 0.0 112.721 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -145.64 168.84 19.69 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 123.236 0.614 . . . . 0.0 110.531 176.017 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 72.8 m -111.1 177.05 4.78 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.187 1.395 . . . . 0.0 113.73 -174.148 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.5 ptpt -41.92 -53.7 3.72 Favored 'General case' 0 C--N 1.339 0.146 0 C-N-CA 126.602 1.961 . . . . 0.0 114.594 -176.46 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 23.5 ttmm -54.75 -50.09 69.26 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 -177.629 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -58.56 -44.14 89.61 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-O 118.693 -0.67 . . . . 0.0 111.098 177.515 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 90.0 mt -59.02 -51.2 71.09 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 119.17 0.896 . . . . 0.0 111.52 176.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 54.5 mtmt -59.01 -47.66 84.39 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 -179.022 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.3 -54.15 48.84 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-O 119.28 -0.39 . . . . 0.0 110.836 174.105 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.6 mt -44.77 -64.4 0.71 Allowed 'General case' 0 CA--C 1.522 -0.109 0 C-N-CA 124.25 1.02 . . . . 0.0 110.425 177.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 18.3 tt -60.24 -49.62 83.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 120.174 -0.61 . . . . 0.0 109.989 -175.28 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -55.93 -49.2 74.16 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.579 0.752 . . . . 0.0 112.332 -176.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.46 -54.4 7.09 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 -176.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -73.8 -29.98 62.47 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 118.302 -0.856 . . . . 0.0 112.72 -168.322 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 59.7 mt . . . . . 0 C--N 1.339 0.126 0 N-CA-C 107.221 -1.399 . . . . 0.0 107.221 167.847 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.8 t70 . . . . . 0 C--O 1.227 -0.128 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -38.54 -61.47 0.7 Allowed 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 125.035 1.334 . . . . 0.0 112.938 -176.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 58.6 tt0 -61.22 -37.82 84.39 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.047 0.539 . . . . 0.0 110.89 -175.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.501 ' CD1' ' H ' ' A' ' 53' ' ' ILE . 0.9 OUTLIER -62.55 -54.18 37.33 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 N-CA-C 105.974 -1.862 . . . . 0.0 105.974 -178.926 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 59.9 t -54.94 -39.76 50.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 CA-C-O 118.118 -0.944 . . . . 0.0 110.702 176.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 12.6 mmmt -59.96 -51.53 69.27 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 120.226 1.376 . . . . 0.0 110.414 176.292 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 85.1 mt -57.34 -37.6 72.8 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 119.322 -0.371 . . . . 0.0 110.828 -179.474 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 24.0 mmt -70.34 -62.85 1.23 Allowed 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 118.59 0.632 . . . . 0.0 109.992 175.503 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -44.29 -42.47 6.71 Favored 'General case' 0 CA--C 1.52 -0.19 0 C-N-CA 127.472 2.309 . . . . 0.0 111.425 -176.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -38.0 -50.87 1.36 Allowed 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.087 1.355 . . . . 0.0 111.391 174.178 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 71.1 mt -60.54 -35.78 76.85 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 121.924 -0.485 . . . . 0.0 111.667 -175.514 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -80.81 -54.76 5.32 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.437 0.695 . . . . 0.0 109.824 179.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 14.7 ttm180 . . . . . 0 N--CA 1.455 -0.178 0 C-N-CA 124.473 1.109 . . . . 0.0 110.044 177.741 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 . . . . . 0 N--CA 1.454 -0.262 0 CA-C-O 120.877 0.37 . . . . 0.0 111.587 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 23.4 m -130.86 147.2 33.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 N-CA-C 105.65 -1.981 . . . . 0.0 105.65 166.641 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -88.53 168.29 12.71 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 122.719 0.408 . . . . 0.0 111.194 175.832 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -33.45 -61.55 0.31 Allowed 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.722 1.209 . . . . 0.0 112.854 171.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 38.6 tp60 -61.92 -33.27 73.94 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 119.794 1.179 . . . . 0.0 112.042 -174.673 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -70.18 -40.01 74.92 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.249 -0.907 . . . . 0.0 110.095 177.076 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -56.92 -48.5 78.11 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 169.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . 0.403 ' CG2' ' CG2' ' B' ' 74' ' ' ILE . 27.3 mm -58.23 -36.64 58.62 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.255 0 O-C-N 121.535 -0.728 . . . . 0.0 110.006 175.701 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 42.5 m -64.35 -38.54 91.4 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.931 0.787 . . . . 0.0 110.489 174.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -55.88 -55.41 32.89 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 172.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 36.3 mt -59.37 -41.98 90.58 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.987 -0.445 . . . . 0.0 112.133 178.262 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.38 -39.96 87.21 Favored Glycine 0 CA--C 1.523 0.593 0 N-CA-C 110.638 -0.985 . . . . 0.0 110.638 -175.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.01 -50.03 67.87 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 117.597 0.699 . . . . 0.0 109.938 173.758 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -47.92 -56.84 6.64 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 123.988 0.915 . . . . 0.0 110.05 175.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.86 -62.5 1.57 Allowed 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 124.677 1.191 . . . . 0.0 110.327 175.081 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 6.5 ttp -54.92 -37.94 67.02 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.121 0.569 . . . . 0.0 112.039 -173.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 73.6 mt -69.82 -57.84 7.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 CA-C-O 117.975 -1.012 . . . . 0.0 110.877 178.083 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.438 0.2 OUTLIER -77.76 -35.14 52.05 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 120.313 1.415 . . . . 0.0 113.814 -174.208 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.3 m120 -80.55 58.79 3.32 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 106.425 -1.694 . . . . 0.0 106.425 168.535 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -47.09 -35.22 6.74 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 126.769 2.028 . . . . 0.0 113.505 -167.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -43.12 -36.95 1.85 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.706 1.203 . . . . 0.0 112.953 175.043 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 34.0 mt . . . . . 0 CA--C 1.529 0.165 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 178.011 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.293 0 CA-C-O 120.881 0.372 . . . . 0.0 110.189 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.09 165.55 1.39 Allowed Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 125.53 1.532 . . . . 0.0 111.756 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo -46.14 -50.77 9.5 Favored 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 123.528 2.819 . . . . 0.0 113.052 177.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' B' ' 5' ' ' LEU . 6.0 mt -55.9 -52.51 63.85 Favored 'General case' 0 C--N 1.34 0.175 0 O-C-N 122.328 -0.233 . . . . 0.0 111.115 175.109 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -58.78 -43.59 90.49 Favored 'General case' 0 C--O 1.225 -0.201 0 N-CA-C 110.118 -0.326 . . . . 0.0 110.118 -175.217 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 tp-100 -61.94 -49.72 75.0 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.147 0.979 . . . . 0.0 110.441 177.534 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.87 -44.2 96.74 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.039 0.536 . . . . 0.0 111.222 -178.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 71.3 mt -54.4 -53.31 31.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 169.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -44.97 -48.25 9.45 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 124.947 1.261 . . . . 0.0 111.923 174.436 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 mt -56.61 -57.93 10.24 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 117.679 0.739 . . . . 0.0 110.895 174.199 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.0 mp -56.41 -42.77 78.54 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 119.483 1.038 . . . . 0.0 111.75 -178.35 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 71.6 mt -59.3 -55.25 24.87 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 C-N-CA 123.508 0.723 . . . . 0.0 110.779 174.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.91 -48.99 69.12 Favored Glycine 0 CA--C 1.523 0.549 0 N-CA-C 110.198 -1.161 . . . . 0.0 110.198 -177.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 9.5 mm -51.25 -49.81 28.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 C-N-CA 124.34 1.056 . . . . 0.0 110.103 173.687 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -56.18 -61.64 2.26 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.082 0.468 . . . . 0.0 109.772 177.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 13.5 m-70 -53.0 -37.09 61.16 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.936 0.894 . . . . 0.0 112.812 -176.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 62.3 tttm -47.12 -35.67 7.45 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.904 0.881 . . . . 0.0 111.368 175.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -102.95 -66.99 0.9 Allowed 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 173.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.227 -0.111 0 C-N-CA 123.899 0.88 . . . . 0.0 112.152 -170.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 13.9 t-160 . . . . . 0 CA--C 1.536 0.44 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 45.4 p -140.07 148.75 42.22 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.329 1.052 . . . . 0.0 113.804 -168.1 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -151.61 173.44 14.65 Favored 'General case' 0 CA--C 1.527 0.067 0 C-N-CA 123.263 0.625 . . . . 0.0 110.03 171.471 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 22.2 p -117.67 174.24 6.28 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 124.495 1.118 . . . . 0.0 113.318 -169.539 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 6.6 pttp -34.79 -59.77 0.47 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 126.867 2.067 . . . . 0.0 112.986 175.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 35.3 tptt -44.87 -49.51 10.87 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 124.558 1.143 . . . . 0.0 111.797 176.597 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -70.34 -36.0 73.94 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 122.902 0.481 . . . . 0.0 110.632 -176.329 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 34.6 mt -64.33 -46.66 82.54 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.647 0.658 . . . . 0.0 110.789 174.673 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -55.6 -51.87 65.7 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 174.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 68.3 mt-10 -56.51 -47.43 79.36 Favored 'General case' 0 C--O 1.218 -0.56 0 CA-C-O 118.969 -0.539 . . . . 0.0 110.856 176.073 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 8.5 mt -51.0 -53.22 35.23 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 119.574 1.079 . . . . 0.0 110.464 179.339 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 1.4 mp -56.09 -58.61 4.51 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 174.597 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -55.23 -43.93 75.01 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -172.254 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 6.9 mmpt? -83.11 -54.59 4.93 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 125.667 1.587 . . . . 0.0 109.916 -172.662 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 44.7 mm-40 -94.42 -17.26 22.68 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 -167.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 67.4 mt . . . . . 0 N--CA 1.457 -0.082 0 C-N-CA 123.907 0.883 . . . . 0.0 108.997 170.793 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 . . . . . 0 C--O 1.226 -0.142 0 N-CA-C 113.523 0.935 . . . . 0.0 113.523 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.49 -60.31 0.15 Allowed 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 126.076 1.75 . . . . 0.0 113.344 -179.195 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -69.75 -36.84 76.15 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 122.248 0.219 . . . . 0.0 111.194 -172.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 53' ' ' ILE . . . . . 0.517 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.3 mp -62.86 -55.3 24.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 178.455 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 78.3 t -55.84 -46.01 79.9 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 C-N-CA 124.709 1.204 . . . . 0.0 110.015 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -53.6 -53.47 51.28 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 118.216 0.462 . . . . 0.0 110.791 173.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 68.7 mt -56.53 -43.86 80.26 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 119.116 -0.468 . . . . 0.0 111.452 178.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 25.7 mmt -62.42 -59.27 5.22 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 118.816 0.734 . . . . 0.0 109.393 178.765 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -54.22 -40.76 67.97 Favored 'General case' 0 N--CA 1.457 -0.112 0 C-N-CA 125.303 1.441 . . . . 0.0 111.007 -175.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -38.93 -50.97 1.78 Allowed 'General case' 0 C--O 1.232 0.158 0 C-N-CA 125.747 1.619 . . . . 0.0 112.555 -173.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 3.0 pp -58.86 -39.26 80.81 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 -176.127 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -77.0 -45.7 26.42 Favored 'General case' 0 N--CA 1.456 -0.157 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 177.51 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 23.4 ttm-85 -48.93 -44.53 40.55 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.532 0.733 . . . . 0.0 109.979 179.086 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 . . . . . 0 CA--C 1.532 0.284 0 C-N-CA 123.1 0.56 . . . . 0.0 111.86 179.561 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 . . . . . 0 N--CA 1.455 -0.209 0 CA-C-O 121.213 0.53 . . . . 0.0 111.818 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 36.0 m -124.9 152.39 31.19 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 C-N-CA 126.607 1.963 . . . . 0.0 106.081 167.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 10.6 p30 -91.5 169.23 10.94 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 123.156 0.582 . . . . 0.0 110.54 175.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -35.58 -60.67 0.5 Allowed 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 125.125 1.37 . . . . 0.0 113.243 177.019 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 37.9 tp60 -63.88 -31.46 72.65 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 119.752 1.16 . . . . 0.0 111.294 -173.012 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.67 -36.39 62.8 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 121.56 -0.712 . . . . 0.0 110.186 177.848 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -56.86 -49.59 75.04 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 168.363 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . 0.403 ' CG2' ' CG2' ' A' ' 74' ' ' ILE . 24.2 mm -57.38 -39.1 66.24 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 O-C-N 121.963 -0.461 . . . . 0.0 110.012 175.821 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 55.3 m -62.45 -40.82 97.85 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 118.946 0.793 . . . . 0.0 110.608 175.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -53.37 -55.98 20.53 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 173.492 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 51.0 mt -61.16 -40.86 95.45 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 179.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -70.26 -43.87 61.7 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 110.788 -0.925 . . . . 0.0 110.788 -174.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.5 -46.89 81.01 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 117.705 0.752 . . . . 0.0 109.894 174.466 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 12.2 tp -49.7 -56.05 11.58 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.419 0.628 . . . . 0.0 109.559 174.274 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.08 -53.63 40.01 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.882 1.273 . . . . 0.0 110.802 177.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 52.9 ttm -54.11 -49.58 68.8 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 124.31 1.044 . . . . 0.0 110.552 -179.65 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 76.4 mt -62.54 -59.19 4.75 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.33 0 CA-C-O 118.701 -0.666 . . . . 0.0 109.586 -176.475 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.388 0.1 OUTLIER -71.25 -35.11 71.3 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 118.467 -1.293 . . . . 0.0 112.938 -174.365 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 37.3 m-80 -81.07 72.08 8.08 Favored 'General case' 0 N--CA 1.462 0.16 0 O-C-N 120.793 -1.192 . . . . 0.0 108.157 170.507 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -43.81 -34.45 1.58 Allowed 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 124.918 1.287 . . . . 0.0 112.725 -179.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -41.1 -42.82 2.08 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.876 1.27 . . . . 0.0 113.189 173.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 96.1 mt . . . . . 0 CA--C 1.532 0.286 0 C-N-CA 123.409 0.684 . . . . 0.0 112.718 -177.432 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.246 0 CA-C-O 121.192 0.52 . . . . 0.0 111.085 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.34 167.79 3.7 Favored Pre-proline 0 CA--C 1.534 0.347 0 C-N-CA 124.795 1.238 . . . . 0.0 111.339 172.878 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_endo -49.63 -45.05 33.08 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 122.926 2.417 . . . . 0.0 111.428 171.28 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.415 HD23 ' HA ' ' A' ' 5' ' ' LEU . 4.1 mt -53.74 -57.35 11.15 Favored 'General case' 0 C--O 1.224 -0.283 0 CA-C-N 118.02 0.373 . . . . 0.0 111.317 171.606 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -56.84 -42.23 79.29 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.176 0.444 . . . . 0.0 110.831 -174.999 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 -59.74 -50.71 72.76 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.54 0.736 . . . . 0.0 110.842 175.509 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.01 -45.96 83.37 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.577 0.751 . . . . 0.0 111.632 -176.462 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 87.1 mt -53.48 -51.02 45.67 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 169.887 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.04 -49.03 18.91 Favored Glycine 0 CA--C 1.528 0.88 0 C-N-CA 124.923 1.249 . . . . 0.0 112.005 173.55 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 mt -56.82 -55.16 37.89 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 117.947 0.873 . . . . 0.0 110.864 174.893 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.0 mp -57.49 -43.6 84.27 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 119.136 0.88 . . . . 0.0 111.38 -179.024 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 95.4 mt -58.32 -53.11 50.65 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.193 0 C-N-CA 123.497 0.719 . . . . 0.0 110.362 174.207 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.42 -49.66 67.53 Favored Glycine 0 CA--C 1.524 0.596 0 N-CA-C 110.322 -1.111 . . . . 0.0 110.322 -177.953 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 9.6 mm -53.32 -48.52 55.91 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 C-N-CA 123.572 0.749 . . . . 0.0 109.885 174.91 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 53.1 t80 -56.09 -61.13 2.59 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.258 0.481 . . . . 0.0 110.056 176.921 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -51.06 -39.69 56.56 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 125.74 1.616 . . . . 0.0 111.503 -176.27 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -50.93 -36.17 37.18 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.715 0.806 . . . . 0.0 111.506 178.913 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -107.05 -38.21 6.09 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.078 0.551 . . . . 0.0 111.654 -177.929 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 59.6 p . . . . . 0 C--O 1.232 0.134 0 CA-C-N 118.801 0.728 . . . . 0.0 111.772 -178.749 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.3 p . . . . . 0 CA--C 1.529 0.167 0 N-CA-C 111.841 0.311 . . . . 0.0 111.841 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -150.21 161.58 42.14 Favored 'General case' 0 CA--C 1.528 0.109 0 C-N-CA 123.034 0.534 . . . . 0.0 111.177 168.649 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 83.7 p -87.07 164.74 16.27 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 115.638 1.718 . . . . 0.0 115.638 -168.063 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 20.7 ttmm -42.6 -54.17 4.09 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 126.878 2.071 . . . . 0.0 109.442 166.685 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -58.01 -54.27 48.79 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.075 0.95 . . . . 0.0 109.782 179.247 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.12 -34.19 73.17 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 118.91 -0.567 . . . . 0.0 111.746 -177.49 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 44.0 mt -65.61 -52.71 49.95 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 119.276 0.943 . . . . 0.0 111.345 173.999 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -60.45 -35.96 77.08 Favored 'General case' 0 CA--C 1.532 0.261 0 O-C-N 122.3 -0.25 . . . . 0.0 110.439 -179.43 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 88.4 mt-10 -60.13 -68.71 0.27 Allowed 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 168.383 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.5 mt -32.57 -61.65 0.26 Allowed 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 125.94 1.696 . . . . 0.0 112.388 -177.965 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.3 tt -57.14 -52.19 59.41 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 110.337 -0.246 . . . . 0.0 110.337 -174.844 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.0 tt0 -64.33 -44.99 89.81 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 121.905 -0.497 . . . . 0.0 111.643 -177.874 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.0 mmpt? -64.6 -51.35 63.16 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 124.894 1.278 . . . . 0.0 110.219 -175.619 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 65.1 mm-40 -90.24 -47.52 7.73 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 123.483 0.713 . . . . 0.0 111.582 -168.911 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 18.1 mt . . . . . 0 C--N 1.339 0.122 0 CA-C-N 118.976 0.807 . . . . 0.0 110.386 -177.828 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 28.0 t70 . . . . . 0 N--CA 1.463 0.208 0 N-CA-C 116.066 1.876 . . . . 0.0 116.066 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -33.03 -59.06 0.36 Allowed 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.591 1.556 . . . . 0.0 113.396 -179.454 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -64.94 -36.88 85.8 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 121.255 0.55 . . . . 0.0 110.775 -173.815 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.499 ' CD1' ' H ' ' A' ' 53' ' ' ILE . 0.8 OUTLIER -65.56 -53.94 33.67 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.572 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 -178.068 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 75.4 t -57.91 -43.82 85.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 CA-C-O 118.633 -0.698 . . . . 0.0 110.451 178.86 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.72 -53.7 51.54 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 119.385 0.993 . . . . 0.0 110.459 174.301 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.6 mt -52.83 -44.26 66.58 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 119.104 -0.474 . . . . 0.0 111.404 178.651 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 25.9 mmt -66.84 -66.15 0.59 Allowed 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.529 0.604 . . . . 0.0 109.456 177.632 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -40.46 -42.68 1.67 Allowed 'General case' 0 CA--C 1.519 -0.243 0 C-N-CA 127.803 2.441 . . . . 0.0 111.648 -176.738 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -39.22 -47.7 1.68 Allowed 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 123.862 0.865 . . . . 0.0 112.72 178.042 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -64.35 -37.22 86.75 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.044 0.384 . . . . 0.0 111.385 -176.162 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -78.87 -36.88 41.52 Favored 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 123.841 0.856 . . . . 0.0 110.104 -178.284 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.2 ttm180 . . . . . 0 N--CA 1.449 -0.494 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 174.448 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 . . . . . 0 N--CA 1.456 -0.15 0 N-CA-C 111.803 0.297 . . . . 0.0 111.803 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 16.3 m -128.04 157.17 40.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.279 0 C-N-CA 125.325 1.45 . . . . 0.0 107.787 168.62 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -87.18 171.28 10.79 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.048 0.939 . . . . 0.0 111.495 173.522 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 68.8 t80 -44.45 -62.43 1.18 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.945 0.898 . . . . 0.0 113.141 176.172 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 37.0 tp60 -61.61 -34.48 75.73 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 119.722 1.146 . . . . 0.0 110.89 -174.795 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 83.5 mt-10 -64.45 -41.06 96.76 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.445 -0.784 . . . . 0.0 110.925 175.029 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -57.47 -47.97 80.44 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 121.606 -0.684 . . . . 0.0 109.899 169.824 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 31.0 mm -60.35 -29.56 44.48 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 O-C-N 121.503 -0.748 . . . . 0.0 110.767 175.281 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 29.2 m -69.93 -40.74 75.34 Favored 'General case' 0 C--O 1.225 -0.196 0 O-C-N 121.215 -0.928 . . . . 0.0 110.197 173.413 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -56.67 -53.67 54.95 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.571 -0.706 . . . . 0.0 109.576 173.413 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 61.2 mt -63.24 -41.12 99.04 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 121.947 -0.471 . . . . 0.0 111.988 178.437 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.79 -41.26 95.77 Favored Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.737 -0.945 . . . . 0.0 110.737 -179.076 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.34 -46.99 87.93 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.269 0.627 . . . . 0.0 110.127 173.453 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 9.8 tp -51.96 -58.3 6.92 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.714 0.768 . . . . 0.0 109.774 175.402 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -47.83 -53.39 15.72 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 114.486 -1.234 . . . . 0.0 110.089 178.077 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 46.0 ttm -57.59 -51.92 67.51 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 123.684 0.794 . . . . 0.0 111.343 -179.437 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 85.6 mt -61.7 -45.13 99.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.613 -173.712 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.457 0.1 OUTLIER -83.08 -33.99 26.27 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 179.982 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 -84.66 85.57 7.42 Favored 'General case' 0 N--CA 1.463 0.222 0 O-C-N 120.845 -1.159 . . . . 0.0 108.93 173.958 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -36.89 -42.06 0.37 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.654 1.181 . . . . 0.0 113.356 171.741 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -55.33 -17.07 4.12 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 125.298 1.439 . . . . 0.0 114.304 -179.516 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 69.8 mt . . . . . 0 CA--C 1.532 0.263 0 C-N-CA 124.608 1.163 . . . . 0.0 112.616 -179.114 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.235 0.299 0 N-CA-C 110.135 -0.32 . . . . 0.0 110.135 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -49.54 155.32 1.38 Allowed Pre-proline 0 CA--C 1.535 0.386 0 C-N-CA 125.354 1.462 . . . . 0.0 109.959 172.189 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_exo -43.76 -52.72 5.09 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 123.38 2.72 . . . . 0.0 113.165 -177.141 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.2 mt -55.44 -55.62 29.57 Favored 'General case' 0 C--O 1.226 -0.153 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 173.514 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -58.18 -38.17 76.15 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-N 118.301 0.5 . . . . 0.0 110.332 -175.048 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -68.55 -49.19 61.39 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 125.088 1.355 . . . . 0.0 110.155 -179.313 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.35 -47.39 86.25 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.553 0.741 . . . . 0.0 110.648 177.991 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 70.0 mt -52.48 -53.86 17.9 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 169.956 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.84 -44.24 17.63 Favored Glycine 0 CA--C 1.526 0.736 0 C-N-CA 125.752 1.644 . . . . 0.0 112.322 175.977 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.68 -53.01 62.96 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.809 0.844 . . . . 0.0 110.686 174.683 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 11.0 mp -58.25 -41.43 84.2 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 119.01 0.823 . . . . 0.0 111.395 178.008 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 84.6 mt -60.29 -51.7 69.91 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 123.651 0.78 . . . . 0.0 110.735 174.563 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.48 -49.21 70.74 Favored Glycine 0 CA--C 1.521 0.445 0 N-CA-C 109.685 -1.366 . . . . 0.0 109.685 -179.083 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.2 mm -54.42 -46.41 70.36 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 C-N-CA 123.139 0.576 . . . . 0.0 110.409 174.594 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 58.5 t80 -55.27 -62.65 1.53 Allowed 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 118.974 0.806 . . . . 0.0 109.949 175.205 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -53.15 -38.42 62.72 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.329 1.052 . . . . 0.0 111.66 -175.092 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -47.86 -38.39 16.06 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.059 0.944 . . . . 0.0 111.391 176.986 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -99.35 -59.09 1.79 Allowed 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 177.343 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 4.7 m . . . . . 0 C--O 1.227 -0.1 0 C-N-CA 124.215 1.006 . . . . 0.0 112.507 -175.019 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 3.8 m80 . . . . . 0 CA--C 1.535 0.396 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 2.4 p -122.56 167.32 13.52 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 127.232 2.213 . . . . 0.0 110.381 -179.888 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -152.53 163.52 39.42 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.771 0.829 . . . . 0.0 109.523 167.568 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 14.5 m -84.98 147.17 26.84 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.265 1.026 . . . . 0.0 110.241 176.987 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -53.7 -31.43 47.97 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 -175.176 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.4 tmmt? -50.34 -43.52 54.1 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.884 -0.51 . . . . 0.0 110.184 172.024 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -65.89 -29.68 70.15 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-O 117.847 -1.073 . . . . 0.0 111.794 177.107 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 89.5 mt -65.5 -48.88 71.05 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 120.522 1.51 . . . . 0.0 109.299 174.409 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 59.4 mtmt -60.5 -44.78 95.62 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.228 179.789 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 72.7 mt-10 -55.07 -66.52 0.39 Allowed 'General case' 0 C--O 1.219 -0.536 0 CA-C-O 118.552 -0.737 . . . . 0.0 109.585 170.252 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 9.4 mt -35.93 -60.56 0.53 Allowed 'General case' 0 C--O 1.23 0.065 0 C-N-CA 125.294 1.437 . . . . 0.0 111.475 -179.82 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 1.5 tp -60.36 -51.68 70.16 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.103 -174.605 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -66.07 -44.75 83.6 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.728 0.694 . . . . 0.0 111.986 -175.463 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 6.9 mmpt? -61.87 -58.89 6.21 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 125.4 1.48 . . . . 0.0 109.26 -179.138 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -79.46 -54.76 5.6 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.782 -0.644 . . . . 0.0 109.3 -170.069 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 42.1 mt . . . . . 0 C--N 1.334 -0.084 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 172.291 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 1.5 p30 . . . . . 0 N--CA 1.466 0.354 0 N-CA-C 113.524 0.935 . . . . 0.0 113.524 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.25 -66.65 0.09 Allowed 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 126.983 2.113 . . . . 0.0 114.221 -174.732 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -65.34 -39.16 92.03 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-O 121.051 0.453 . . . . 0.0 110.222 -171.024 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 53' ' ' ILE . . . . . 0.647 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.6 mp -64.35 -54.23 33.42 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 -176.946 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 75.6 t -58.09 -44.05 86.55 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.459 0 CA-C-O 118.406 -0.807 . . . . 0.0 110.196 178.794 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -54.92 -52.87 61.6 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 119.528 1.058 . . . . 0.0 110.509 174.396 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 37.0 mt -54.21 -46.18 72.39 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 119.17 -0.443 . . . . 0.0 111.243 179.496 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 26.5 mmt -66.9 -59.24 3.68 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.534 0.683 . . . . 0.0 109.868 179.309 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -48.71 -39.73 25.77 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 126.58 1.952 . . . . 0.0 111.337 -177.079 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -37.6 -50.22 1.14 Allowed 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 126.024 1.73 . . . . 0.0 112.507 -174.195 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 3.1 pp -62.97 -35.57 80.61 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 -175.366 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -85.99 -33.2 21.15 Favored 'General case' 0 C--O 1.224 -0.286 0 C-N-CA 123.184 0.593 . . . . 0.0 110.457 178.512 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 6.6 ttp180 -58.86 -56.62 19.84 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 122.111 0.957 . . . . 0.0 108.603 175.186 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 . . . . . 0 N--CA 1.45 -0.452 0 C-N-CA 124.238 1.015 . . . . 0.0 109.74 -172.73 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 . . . . . 0 N--CA 1.453 -0.302 0 CA-C-O 120.358 0.123 . . . . 0.0 110.923 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 6.0 m -136.88 160.0 36.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 C-N-CA 124.122 0.969 . . . . 0.0 109.471 169.236 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 17.4 p30 -85.94 169.2 13.48 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 125.759 1.623 . . . . 0.0 110.886 174.327 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -39.92 -58.75 1.33 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.982 1.313 . . . . 0.0 113.664 173.932 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 38.4 tp60 -61.76 -40.97 97.0 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 120.786 -1.196 . . . . 0.0 110.981 -174.239 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -68.02 -33.82 75.32 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.78 -0.575 . . . . 0.0 110.862 177.94 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -57.72 -55.09 39.33 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 168.669 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 22.1 mm -52.79 -42.62 42.89 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.212 0 C-N-CA 122.821 0.448 . . . . 0.0 109.95 179.7 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 49.5 m -55.4 -36.29 66.28 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 122.779 0.432 . . . . 0.0 111.376 178.425 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 18.3 t80 -58.46 -53.1 62.09 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 174.969 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 41.8 mt -60.51 -43.07 97.45 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.056 0.542 . . . . 0.0 111.17 178.715 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.23 -46.77 86.05 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 -176.654 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.39 -46.92 88.15 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 117.696 0.748 . . . . 0.0 110.543 175.84 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -51.83 -56.15 15.72 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.766 0.793 . . . . 0.0 109.983 174.426 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.43 -48.98 65.44 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 124.113 0.965 . . . . 0.0 110.474 178.457 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 50.3 ttm -58.3 -49.5 76.93 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.912 0.885 . . . . 0.0 110.971 179.855 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 84.1 mt -64.6 -43.39 96.72 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 CA-C-O 118.186 -0.912 . . . . 0.0 111.233 -175.596 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.445 1.3 p90 -79.43 -40.34 30.18 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.784 1.174 . . . . 0.0 113.607 178.694 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 37.4 m-80 -79.14 70.73 5.56 Favored 'General case' 0 N--CA 1.462 0.136 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 170.567 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -40.89 -41.98 1.73 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.521 1.528 . . . . 0.0 112.6 -174.841 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.29 -54.33 0.4 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.766 1.626 . . . . 0.0 113.044 169.954 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 85.4 mt . . . . . 0 C--O 1.225 -0.235 0 C-N-CA 124.146 0.978 . . . . 0.0 113.146 -173.555 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.225 0 CA-C-O 120.862 0.363 . . . . 0.0 110.238 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 4.2 m -53.35 160.54 1.74 Allowed Pre-proline 0 CA--C 1.536 0.442 0 C-N-CA 124.278 1.031 . . . . 0.0 111.113 175.09 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_exo -43.15 -49.5 7.13 Favored 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 123.528 2.819 . . . . 0.0 113.172 176.28 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.431 HD23 ' HA ' ' A' ' 5' ' ' LEU . 7.3 mt -57.25 -48.5 78.68 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 119.305 -0.379 . . . . 0.0 111.719 174.577 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -59.41 -47.18 86.46 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 118.548 0.613 . . . . 0.0 109.666 -177.081 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 16.0 tt0 -56.08 -52.69 63.38 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.355 0.662 . . . . 0.0 110.375 176.209 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.52 -45.11 84.75 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.383 0.673 . . . . 0.0 112.023 -174.606 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 76.0 mt -55.69 -50.18 69.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 171.534 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.21 -50.03 17.68 Favored Glycine 0 CA--C 1.528 0.863 0 C-N-CA 124.422 1.011 . . . . 0.0 111.488 173.609 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.1 mt -55.83 -56.76 16.77 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 117.586 0.693 . . . . 0.0 111.282 174.848 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -58.32 -44.14 88.51 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 119.257 0.935 . . . . 0.0 111.639 -177.659 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 96.3 mt -56.49 -54.91 22.77 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.2 0 C-N-CA 123.413 0.685 . . . . 0.0 110.198 173.181 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.64 -50.15 58.62 Favored Glycine 0 CA--C 1.523 0.567 0 N-CA-C 110.364 -1.094 . . . . 0.0 110.364 -177.351 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 9.5 mm -54.27 -47.62 68.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 C-N-CA 123.229 0.611 . . . . 0.0 110.107 175.915 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 50.6 t80 -56.1 -59.35 5.05 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.401 0.546 . . . . 0.0 109.998 176.506 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -56.62 -35.47 68.34 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.734 1.214 . . . . 0.0 111.514 -173.732 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -48.88 -36.33 16.81 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.943 0.897 . . . . 0.0 111.779 177.143 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 54.6 m-85 -106.81 -55.73 2.29 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.34 0.656 . . . . 0.0 109.393 178.461 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.531 0.217 0 C-N-CA 124.103 0.961 . . . . 0.0 111.645 -176.38 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.3 p . . . . . 0 N--CA 1.454 -0.242 0 N-CA-C 111.27 0.1 . . . . 0.0 111.27 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -144.46 163.56 33.45 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.573 0.349 . . . . 0.0 111.526 169.709 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 9.7 m -89.36 159.89 17.12 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.095 0.958 . . . . 0.0 113.438 -170.667 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 51.6 pttt -45.99 -42.84 13.64 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 125.272 1.429 . . . . 0.0 112.184 171.793 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 23.2 ttmm -51.97 -50.47 61.2 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 123.483 0.713 . . . . 0.0 110.302 172.815 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 -65.83 -39.99 91.35 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 118.776 -0.631 . . . . 0.0 110.324 -176.897 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 76.0 mt -58.82 -54.97 41.13 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.77 0.713 . . . . 0.0 111.161 173.462 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 61.8 mttm -56.56 -44.27 80.8 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.236 0.614 . . . . 0.0 110.187 -178.422 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -56.81 -67.93 0.27 Allowed 'General case' 0 C--O 1.219 -0.507 0 CA-C-O 118.423 -0.799 . . . . 0.0 109.473 170.555 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.7 mt -34.07 -62.98 0.3 Allowed 'General case' 0 N--CA 1.463 0.209 0 C-N-CA 125.594 1.558 . . . . 0.0 112.132 -178.542 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 18.1 tt -61.26 -48.0 90.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 C-N-CA 120.899 -0.321 . . . . 0.0 110.265 -174.356 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -62.91 -45.55 91.98 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.783 -0.573 . . . . 0.0 111.712 -178.065 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.2 mmpt? -65.07 -58.68 5.44 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 125.397 1.479 . . . . 0.0 109.059 -176.727 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -77.78 -62.36 1.69 Allowed 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.311 -173.226 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 32.8 mt . . . . . 0 N--CA 1.45 -0.427 0 CA-C-O 121.394 0.616 . . . . 0.0 109.557 -174.956 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 38.2 t70 . . . . . 0 N--CA 1.463 0.197 0 N-CA-C 115.207 1.558 . . . . 0.0 115.207 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -31.99 -58.15 0.3 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 125.49 1.516 . . . . 0.0 113.35 176.866 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -65.92 -38.42 88.64 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 121.268 0.556 . . . . 0.0 111.197 -175.289 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.503 ' CD1' ' H ' ' A' ' 53' ' ' ILE . 1.0 OUTLIER -66.06 -50.13 71.55 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 N-CA-C 106.864 -1.532 . . . . 0.0 106.864 -176.157 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 71.6 t -55.49 -54.31 26.87 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 CA-C-O 118.475 -0.774 . . . . 0.0 109.364 174.682 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -47.98 -54.45 12.82 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.629 0.65 . . . . 0.0 110.847 179.332 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 12.8 mt -51.94 -43.35 63.42 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 122.879 0.472 . . . . 0.0 112.197 -177.249 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -78.69 -59.38 2.8 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 122.926 0.49 . . . . 0.0 110.335 -179.661 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -39.71 -37.2 0.49 Allowed 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 126.785 2.034 . . . . 0.0 111.872 176.575 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -36.75 -57.3 0.8 Allowed 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 125.239 1.416 . . . . 0.0 111.408 172.871 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -65.42 -30.75 71.59 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 121.856 -0.527 . . . . 0.0 111.658 -174.346 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -82.1 -36.67 27.33 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.43 0.692 . . . . 0.0 110.523 -175.036 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 13.1 ptt180 . . . . . 0 CA--C 1.532 0.269 0 CA-C-N 118.813 0.733 . . . . 0.0 109.422 173.714 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 . . . . . 0 CA--C 1.528 0.13 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.7 m -134.37 159.43 42.01 Favored 'Isoleucine or valine' 0 C--O 1.232 0.159 0 C-N-CA 126.224 1.81 . . . . 0.0 107.805 169.406 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -91.44 174.26 7.47 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 123.612 0.765 . . . . 0.0 111.59 175.798 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 49.3 t80 -42.31 -63.46 0.75 Allowed 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.376 1.07 . . . . 0.0 112.84 173.839 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -61.64 -35.25 77.38 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 120.329 1.422 . . . . 0.0 111.694 -176.179 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -63.6 -41.4 98.32 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 119.836 1.198 . . . . 0.0 111.315 174.33 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -55.04 -51.63 65.69 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 121.01 -1.056 . . . . 0.0 109.608 169.853 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 23.8 mm -55.97 -36.13 43.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 C-N-CA 122.804 0.442 . . . . 0.0 110.245 176.395 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 56.8 m -67.2 -34.48 77.6 Favored 'General case' 0 C--O 1.225 -0.223 0 O-C-N 121.302 -0.874 . . . . 0.0 110.635 177.06 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -53.91 -54.48 38.2 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 169.813 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 59.6 mt -64.2 -41.36 97.11 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.306 0.642 . . . . 0.0 112.034 -178.254 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -70.16 -44.46 60.27 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.416 -1.073 . . . . 0.0 110.416 -176.689 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.08 -49.58 76.74 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 122.171 -0.605 . . . . 0.0 109.754 174.393 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 11.1 tp -48.45 -59.27 3.61 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.464 0.65 . . . . 0.0 109.988 173.922 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -49.64 -53.02 26.59 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.804 1.242 . . . . 0.0 110.581 179.773 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 14.2 ttp -67.1 -36.61 82.31 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 123.357 0.663 . . . . 0.0 111.92 -175.166 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.93 -59.39 4.35 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 CA-C-N 118.791 0.723 . . . . 0.0 109.52 175.679 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.417 0.3 OUTLIER -70.91 -38.33 72.95 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 118.512 -1.275 . . . . 0.0 112.424 -174.21 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -81.78 67.68 7.85 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 120.545 -1.347 . . . . 0.0 107.639 168.994 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -41.24 -40.13 1.53 Allowed 'General case' 0 N--CA 1.462 0.155 0 C-N-CA 125.767 1.627 . . . . 0.0 112.293 -175.242 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -34.55 -53.28 0.52 Allowed 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 125.352 1.461 . . . . 0.0 113.037 172.401 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 90.9 mt . . . . . 0 C--O 1.225 -0.23 0 N-CA-C 113.156 0.798 . . . . 0.0 113.156 -174.226 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.531 0.227 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 11.9 m -53.8 159.7 2.51 Favored Pre-proline 0 CA--C 1.537 0.479 0 C-N-CA 123.741 0.816 . . . . 0.0 111.147 176.512 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_exo -42.11 -48.83 6.19 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 123.868 3.045 . . . . 0.0 113.507 177.645 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 6.3 mt -54.25 -51.11 65.55 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 119.564 -0.255 . . . . 0.0 111.521 174.051 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -62.99 -40.46 97.8 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 118.254 0.479 . . . . 0.0 110.144 -175.674 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.7 tp60 -63.9 -46.35 85.24 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 122.512 -0.118 . . . . 0.0 110.96 176.391 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.31 -46.01 88.71 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.593 0.757 . . . . 0.0 110.819 -179.313 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 63.0 mt -52.84 -53.23 22.27 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.254 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 169.678 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.77 -46.66 18.86 Favored Glycine 0 CA--C 1.528 0.854 0 C-N-CA 125.164 1.364 . . . . 0.0 112.05 175.422 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 mt -58.09 -54.19 49.81 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 117.71 0.755 . . . . 0.0 111.166 174.534 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 9.9 mp -57.91 -42.78 85.49 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 118.791 0.723 . . . . 0.0 111.407 179.323 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 85.9 mt -56.4 -56.13 15.27 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.401 0 C-N-CA 123.629 0.772 . . . . 0.0 109.669 173.316 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.2 -48.8 62.23 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.749 -0.94 . . . . 0.0 110.749 -177.754 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 9.1 mm -56.44 -47.23 81.93 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 175.978 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -55.99 -60.81 2.94 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 118.626 0.648 . . . . 0.0 109.923 176.484 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -43.32 -50.1 6.73 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 128.168 2.587 . . . . 0.0 110.467 -177.992 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -48.38 -36.84 15.41 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.583 1.153 . . . . 0.0 112.355 178.266 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 -119.48 36.12 4.6 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.124 0.97 . . . . 0.0 111.236 179.875 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 19.9 p . . . . . 0 N--CA 1.466 0.372 0 O-C-N 121.309 -0.869 . . . . 0.0 109.793 172.505 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 20.1 t-160 . . . . . 0 CA--C 1.54 0.595 0 N-CA-C 111.358 0.132 . . . . 0.0 111.358 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 73.4 p -128.33 164.81 21.83 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 124.819 1.248 . . . . 0.0 112.393 -173.136 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 3.4 pp -156.49 178.18 10.61 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.88 1.672 . . . . 0.0 107.225 169.78 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 61.8 p -123.46 177.03 5.82 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 119.326 0.966 . . . . 0.0 112.43 -177.369 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 7.0 ptpp? -40.3 -46.88 2.4 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 125.475 1.51 . . . . 0.0 112.945 175.659 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -62.59 -42.64 99.68 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -176.3 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -67.58 -41.44 84.12 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.301 178.182 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 34' ' ' LEU . . . . . 0.499 HD12 HD21 ' B' ' 63' ' ' ASN . 13.7 mt -58.98 -48.89 79.95 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 119.424 1.011 . . . . 0.0 111.107 175.23 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -57.22 -50.52 72.62 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 178.341 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 64.2 mt-10 -50.8 -62.25 1.72 Allowed 'General case' 0 C--O 1.223 -0.334 0 CA-C-O 119.432 -0.318 . . . . 0.0 110.359 173.619 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 12.3 mt -43.1 -64.86 0.56 Allowed 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.86 1.264 . . . . 0.0 110.841 179.573 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 13.8 tt -61.66 -47.73 91.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 C-N-CA 120.452 -0.499 . . . . 0.0 110.382 -171.456 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -67.37 -49.38 64.19 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 118.271 0.487 . . . . 0.0 111.819 -176.009 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.15 -55.38 16.65 Favored 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 -178.054 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -73.03 -51.21 19.05 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 122.354 -0.216 . . . . 0.0 110.43 -172.211 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 96.0 mt . . . . . 0 C--O 1.226 -0.139 0 CA-C-O 121.205 0.526 . . . . 0.0 111.099 -174.043 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 . . . . . 0 N--CA 1.463 0.214 0 N-CA-C 114.66 1.356 . . . . 0.0 114.66 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.68 -60.63 0.15 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.999 1.72 . . . . 0.0 114.264 -179.198 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -65.59 -38.69 90.23 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 121.306 0.574 . . . . 0.0 111.307 -174.058 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 53' ' ' ILE . . . . . 0.624 HD12 ' H ' ' B' ' 53' ' ' ILE . 2.4 mp -67.69 -52.97 34.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.548 0 N-CA-C 106.597 -1.631 . . . . 0.0 106.597 -176.443 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 55.4 t -49.18 -48.92 17.41 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 C-N-CA 125.003 1.321 . . . . 0.0 109.645 173.467 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -57.67 -50.02 74.56 Favored 'General case' 0 N--CA 1.457 -0.111 0 CA-C-N 118.577 0.626 . . . . 0.0 111.119 177.708 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 23.9 mt -54.74 -36.6 64.96 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 119.111 -0.471 . . . . 0.0 111.487 177.381 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 28.1 mmt -70.1 -59.52 2.85 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 118.963 0.801 . . . . 0.0 109.838 174.676 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 81.0 m-20 -45.55 -37.39 5.4 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 126.549 1.94 . . . . 0.0 111.27 -178.483 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -38.08 -51.9 1.41 Allowed 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 126.039 1.736 . . . . 0.0 111.029 176.398 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -59.77 -47.42 85.74 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 122.702 0.401 . . . . 0.0 110.35 -177.864 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -63.1 -53.96 45.41 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 122.703 0.401 . . . . 0.0 110.072 -179.418 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 61.4 mtp180 -54.98 -41.86 71.73 Favored 'General case' 0 N--CA 1.456 -0.157 0 O-C-N 121.955 -0.466 . . . . 0.0 110.301 179.897 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 63' ' ' ASN . . . . . 0.499 HD21 HD12 ' B' ' 34' ' ' LEU . 15.4 m-80 . . . . . 0 N--CA 1.455 -0.195 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 179.098 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 . . . . . 0 N--CA 1.453 -0.277 0 CA-C-O 120.94 0.4 . . . . 0.0 110.74 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 10.1 m -130.92 158.63 43.26 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 C-N-CA 126.686 1.995 . . . . 0.0 106.666 168.849 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -99.81 175.2 5.87 Favored 'General case' 0 N--CA 1.462 0.13 0 C-N-CA 124.053 0.941 . . . . 0.0 111.13 177.688 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -40.96 -63.83 0.62 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.239 1.015 . . . . 0.0 112.61 172.38 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 50.9 tp60 -61.52 -36.34 80.28 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 119.59 1.087 . . . . 0.0 111.711 -174.842 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -62.7 -43.01 99.9 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.374 -0.829 . . . . 0.0 110.775 175.62 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -56.29 -51.29 68.71 Favored 'General case' 0 CA--C 1.535 0.403 0 O-C-N 121.838 -0.539 . . . . 0.0 109.884 170.975 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 27.5 mm -55.58 -37.57 46.4 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 O-C-N 121.959 -0.463 . . . . 0.0 110.289 177.554 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 47.8 m -64.76 -37.11 86.51 Favored 'General case' 0 CA--C 1.529 0.139 0 O-C-N 121.682 -0.636 . . . . 0.0 110.603 175.95 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -55.82 -52.98 62.14 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 173.663 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 54.6 mt -62.29 -44.69 95.94 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.55 179.377 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -60.99 -47.91 88.9 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 110.681 -0.968 . . . . 0.0 110.681 -178.901 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.16 -41.22 94.9 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 122.147 -0.619 . . . . 0.0 110.407 177.433 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 23.0 tp -54.04 -56.82 14.36 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 118.636 0.653 . . . . 0.0 109.688 174.611 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -48.58 -50.92 30.36 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 124.524 1.129 . . . . 0.0 109.989 175.891 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 44.7 ttm -58.15 -49.11 78.12 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.209 0.604 . . . . 0.0 111.669 -179.078 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 81.1 mt -65.27 -51.12 68.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.67 -176.033 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.45 0.1 OUTLIER -76.34 -38.64 55.63 Favored 'General case' 0 C--N 1.345 0.392 0 CA-C-N 119.678 1.127 . . . . 0.0 112.958 -177.153 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 23.2 m-80 -82.93 68.57 9.47 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 169.33 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 87.8 mt-10 -41.56 -38.57 1.37 Allowed 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 125.749 1.619 . . . . 0.0 112.688 -173.309 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -35.44 -53.97 0.66 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.046 1.338 . . . . 0.0 112.768 171.583 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 92.3 mt . . . . . 0 CA--C 1.53 0.178 0 C-N-CA 124.037 0.935 . . . . 0.0 113.347 -174.46 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.1 mtm . . . . . 0 N--CA 1.475 0.787 0 CA-C-O 120.671 0.272 . . . . 0.0 110.865 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.26 68.55 3.4 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 176.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -56.57 165.04 1.76 Allowed Pre-proline 0 CA--C 1.538 0.499 0 C-N-CA 124.651 1.18 . . . . 0.0 111.461 -179.556 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -44.03 -48.49 9.32 Favored 'Trans proline' 0 N--CA 1.458 -0.563 0 C-N-CA 123.805 3.004 . . . . 0.0 113.535 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.1 mt -53.39 -56.7 14.59 Favored 'General case' 0 C--O 1.226 -0.173 0 CA-C-N 117.66 0.209 . . . . 0.0 111.47 173.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -59.82 -41.78 92.05 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -174.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 tp-100 -60.47 -50.13 74.81 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.619 0.767 . . . . 0.0 110.437 176.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.31 -44.77 94.02 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.331 0.652 . . . . 0.0 111.213 -178.28 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 74.1 mt -52.41 -53.01 21.54 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 N-CA-C 108.084 -1.08 . . . . 0.0 108.084 169.676 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.55 -47.97 17.24 Favored Glycine 0 CA--C 1.528 0.85 0 C-N-CA 125.254 1.406 . . . . 0.0 112.029 174.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 mt -56.77 -55.9 28.39 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 117.904 0.852 . . . . 0.0 111.051 174.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -56.92 -42.61 80.3 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 119.152 0.887 . . . . 0.0 111.318 -179.127 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 87.3 mt -57.11 -54.42 30.46 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.259 0 C-N-CA 123.305 0.642 . . . . 0.0 110.843 172.774 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.91 -49.87 64.32 Favored Glycine 0 CA--C 1.524 0.646 0 N-CA-C 110.211 -1.155 . . . . 0.0 110.211 -177.387 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 12.5 mm -52.48 -50.14 40.66 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 C-N-CA 124.027 0.931 . . . . 0.0 110.067 175.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -53.79 -62.29 1.75 Allowed 'General case' 0 CA--C 1.532 0.276 0 CA-C-O 121.346 0.593 . . . . 0.0 109.822 176.088 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -55.39 -35.12 64.98 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.001 0.92 . . . . 0.0 111.873 -173.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -48.7 -36.3 15.87 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.886 0.874 . . . . 0.0 111.659 176.416 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 56.3 m-85 -103.61 -56.43 2.21 Favored 'General case' 0 C--N 1.339 0.14 0 C-N-CA 123.125 0.57 . . . . 0.0 109.756 176.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.0 m -50.54 -37.24 38.25 Favored 'General case' 0 C--O 1.227 -0.08 0 C-N-CA 123.533 0.733 . . . . 0.0 111.93 -176.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -40.48 -43.28 2.84 Favored Glycine 0 CA--C 1.526 0.73 0 C-N-CA 124.64 1.114 . . . . 0.0 112.933 174.391 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 24.4 mtpp -72.78 -21.81 60.93 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 122.687 0.395 . . . . 0.0 111.989 -174.108 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -80.58 2.06 27.15 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.67 0.788 . . . . 0.0 112.685 -170.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 75.78 -67.68 2.29 Favored Glycine 0 CA--C 1.526 0.757 0 N-CA-C 110.26 -1.136 . . . . 0.0 110.26 179.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -78.6 65.11 3.79 Favored 'General case' 0 CA--C 1.529 0.153 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 170.34 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 8.9 ptpt -66.31 5.02 0.61 Allowed 'General case' 0 CA--C 1.532 0.276 0 N-CA-C 115.146 1.536 . . . . 0.0 115.146 -169.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 6.3 m80 -79.26 -14.99 58.68 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 125.68 1.592 . . . . 0.0 109.668 169.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 69.5 p -128.17 169.4 14.17 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 126.299 1.839 . . . . 0.0 110.815 179.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.83 -171.73 3.21 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 125.952 1.701 . . . . 0.0 107.556 168.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 92.2 p -145.49 177.0 9.17 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 119.589 1.086 . . . . 0.0 112.672 -176.156 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -18.61 -64.64 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 130.919 3.687 . . . . 0.0 113.257 172.402 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.09 -53.23 59.57 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 123.918 0.887 . . . . 0.0 111.201 -178.016 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 7.1 mp0 -61.87 -38.08 86.95 Favored 'General case' 0 C--O 1.222 -0.357 0 C-N-CA 123.077 0.551 . . . . 0.0 110.424 179.481 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 43.7 mt -64.81 -48.78 73.17 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 118.676 0.671 . . . . 0.0 110.979 178.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -57.69 -47.9 81.04 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 110.218 -0.29 . . . . 0.0 110.218 175.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -52.14 -59.14 4.72 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-O 119.396 -0.335 . . . . 0.0 110.695 172.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.3 mt -45.01 -61.53 1.59 Allowed 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 124.771 1.228 . . . . 0.0 110.551 -178.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 12.5 tt -62.08 -51.55 71.07 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 119.983 -0.687 . . . . 0.0 109.717 -174.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -61.88 -44.8 96.07 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.8 -0.562 . . . . 0.0 112.263 -174.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -75.12 -58.28 3.38 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 -177.545 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 18.0 mp0 -77.66 -18.82 56.32 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-O 117.634 -1.174 . . . . 0.0 113.305 -168.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 67.0 mt -102.76 92.44 4.61 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-N 120.133 1.333 . . . . 0.0 107.639 167.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 68.6 p -77.38 60.24 1.99 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.358 1.063 . . . . 0.0 109.184 -179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 33.5 mt -86.58 -55.05 7.06 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 C-N-CA 124.751 1.221 . . . . 0.0 109.207 -173.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.8 -67.47 1.34 Allowed Glycine 0 CA--C 1.531 1.037 0 N-CA-C 110.707 -0.957 . . . . 0.0 110.707 -174.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 60.5 p -72.01 78.82 0.92 Allowed 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.739 0.816 . . . . 0.0 109.454 175.129 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -33.15 92.69 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 127.615 2.366 . . . . 0.0 112.105 175.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 95.2 mt -61.79 117.98 6.57 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.814 0.845 . . . . 0.0 113.032 -169.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 61.94 -78.0 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 126.102 1.761 . . . . 0.0 113.607 167.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -168.11 -47.3 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.2 0 C-N-CA 124.226 1.011 . . . . 0.0 109.826 -169.448 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -34.89 -63.21 0.33 Allowed 'General case' 0 N--CA 1.456 -0.147 0 C-N-CA 125.144 1.378 . . . . 0.0 112.796 -178.074 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 67.4 tt0 -62.9 -37.01 85.22 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.327 0.651 . . . . 0.0 111.456 -174.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.495 ' CD1' ' H ' ' A' ' 53' ' ' ILE . 0.9 OUTLIER -62.37 -53.99 40.11 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 N-CA-C 105.868 -1.901 . . . . 0.0 105.868 -179.193 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 75.1 t -57.15 -41.19 77.36 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.606 0 CA-C-O 118.035 -0.983 . . . . 0.0 110.498 177.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 14.6 mmmt -58.18 -51.7 68.66 Favored 'General case' 0 C--O 1.231 0.116 0 CA-C-N 120.167 1.349 . . . . 0.0 110.192 176.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 49.5 mt -55.73 -43.77 76.9 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 119.162 -0.447 . . . . 0.0 110.925 179.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 22.1 mmt -67.15 -60.75 2.35 Favored 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 118.807 0.73 . . . . 0.0 109.624 178.466 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -42.73 -45.56 4.8 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 126.746 2.018 . . . . 0.0 111.213 -178.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -39.41 -47.79 1.84 Allowed 'General case' 0 C--O 1.234 0.252 0 C-N-CA 124.578 1.151 . . . . 0.0 112.36 178.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -57.99 -48.22 80.64 Favored 'General case' 0 N--CA 1.456 -0.159 0 CA-C-O 119.456 -0.307 . . . . 0.0 110.345 -178.356 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -71.02 -49.05 49.26 Favored 'General case' 0 C--O 1.227 -0.126 0 CA-C-N 118.14 0.427 . . . . 0.0 110.335 -178.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 54.5 ttt85 -49.95 -43.54 50.04 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 124.788 1.235 . . . . 0.0 110.613 -178.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 12.9 m-80 -86.63 -58.87 2.45 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 122.434 0.294 . . . . 0.0 111.054 179.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . 0.366 17.3 ptpt 48.19 -72.98 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 127.74 2.416 . . . . 0.0 113.295 -168.083 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -143.37 26.9 1.59 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.109 0.964 . . . . 0.0 111.131 176.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.2 mp0 -128.75 142.21 51.07 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 123.796 0.838 . . . . 0.0 110.366 179.306 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 22.2 mp0 -69.89 151.8 45.25 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.314 1.046 . . . . 0.0 108.286 168.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.2 m -108.39 149.44 11.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 169.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 17.9 p30 -88.69 170.66 10.61 Favored 'General case' 0 C--O 1.23 0.077 0 C-N-CA 124.325 1.05 . . . . 0.0 110.832 175.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -38.58 -61.42 0.71 Allowed 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.83 1.252 . . . . 0.0 113.74 174.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 40.8 tp60 -62.66 -38.75 91.54 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-N 120.025 1.284 . . . . 0.0 110.669 -174.433 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.85 -33.5 75.98 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.888 -0.507 . . . . 0.0 110.947 176.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -61.18 -53.27 59.11 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 118.841 0.746 . . . . 0.0 109.182 168.679 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 24.2 mm -52.24 -42.54 37.0 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 C-N-CA 122.844 0.458 . . . . 0.0 110.097 179.711 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 34.0 m -54.17 -37.76 64.81 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.049 0.54 . . . . 0.0 111.378 177.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -57.34 -50.18 73.78 Favored 'General case' 0 CA--C 1.537 0.449 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 176.026 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 51.5 mt -65.63 -43.65 88.86 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.186 0.595 . . . . 0.0 111.329 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.63 -43.41 97.97 Favored Glycine 0 CA--C 1.529 0.919 0 N-CA-C 110.945 -0.862 . . . . 0.0 110.945 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.81 -49.84 73.35 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 123.095 0.558 . . . . 0.0 110.383 175.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 16.4 tp -47.37 -56.48 6.81 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.401 0.619 . . . . 0.0 109.948 173.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.96 -53.57 39.77 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-N 115.001 -1.0 . . . . 0.0 110.555 -179.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 9.2 mtm -57.46 -50.45 72.99 Favored 'General case' 0 N--CA 1.455 -0.203 0 O-C-N 123.327 0.392 . . . . 0.0 111.861 179.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 84.0 mt -63.41 -49.96 80.61 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 CA-C-O 117.79 -1.1 . . . . 0.0 110.34 -174.139 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.467 0.4 OUTLIER -78.18 -40.36 37.97 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-N 120.256 1.389 . . . . 0.0 113.504 -178.508 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.0 m-80 -82.53 67.22 8.49 Favored 'General case' 0 N--CA 1.465 0.277 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 169.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 90.2 mt-10 -41.37 -42.64 2.29 Favored 'General case' 0 N--CA 1.461 0.099 0 C-N-CA 125.281 1.432 . . . . 0.0 112.12 -172.181 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -31.42 -52.75 0.22 Allowed 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 126.561 1.944 . . . . 0.0 113.372 171.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 63.8 mt -59.24 -24.08 62.89 Favored 'General case' 0 C--O 1.224 -0.256 0 C-N-CA 123.717 0.807 . . . . 0.0 113.103 -175.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 32.4 mtmm -77.76 -15.07 59.37 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 119.522 1.055 . . . . 0.0 111.59 177.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.161 0 CA-C-O 117.205 -1.886 . . . . 0.0 111.185 -178.158 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 91.6 mmm . . . . . 0 N--CA 1.475 0.788 0 CA-C-O 120.404 0.145 . . . . 0.0 110.636 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -78.41 64.48 3.5 Favored 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 176.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.3 m -57.54 165.91 1.99 Allowed Pre-proline 0 CA--C 1.537 0.477 0 C-N-CA 125.082 1.353 . . . . 0.0 111.109 179.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 99.1 Cg_exo -45.45 -47.53 12.96 Favored 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 123.524 2.816 . . . . 0.0 113.477 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.9 mt -54.39 -55.53 27.7 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-N 117.817 0.28 . . . . 0.0 111.435 173.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -59.43 -39.67 84.27 Favored 'General case' 0 C--O 1.225 -0.22 0 N-CA-C 110.385 -0.228 . . . . 0.0 110.385 -176.021 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 12.4 tp-100 -63.37 -50.41 70.04 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.507 0.723 . . . . 0.0 110.501 177.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.28 -45.03 93.34 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.313 0.645 . . . . 0.0 111.095 -178.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 72.7 mt -53.14 -53.23 23.79 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 N-CA-C 108.107 -1.071 . . . . 0.0 108.107 169.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.43 -45.86 16.82 Favored Glycine 0 CA--C 1.526 0.751 0 C-N-CA 125.69 1.614 . . . . 0.0 112.176 175.328 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.7 mt -57.87 -55.99 27.8 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 117.751 0.776 . . . . 0.0 110.97 173.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.6 mp -58.69 -43.02 89.85 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.18 0.9 . . . . 0.0 111.608 -179.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 75.0 mt -54.12 -57.23 6.34 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 C-N-CA 124.09 0.956 . . . . 0.0 109.981 171.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.02 -50.44 58.91 Favored Glycine 0 CA--C 1.522 0.497 0 N-CA-C 110.249 -1.14 . . . . 0.0 110.249 -176.019 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 13.9 mm -51.56 -50.28 30.55 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 C-N-CA 123.523 0.729 . . . . 0.0 110.04 175.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 44.3 t80 -56.9 -57.72 11.26 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.252 178.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -56.72 -38.44 72.35 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.843 0.857 . . . . 0.0 111.139 -174.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -46.09 -39.14 8.93 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 124.601 1.161 . . . . 0.0 111.571 -179.342 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -107.2 -52.01 2.83 Favored 'General case' 0 CA--C 1.528 0.129 0 C-N-CA 122.542 0.337 . . . . 0.0 110.11 178.341 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 5.6 m -52.72 -36.17 57.05 Favored 'General case' 0 CA--C 1.527 0.081 0 C-N-CA 123.573 0.749 . . . . 0.0 111.981 -177.01 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -41.15 -47.5 4.35 Favored Glycine 0 CA--C 1.527 0.832 0 C-N-CA 124.192 0.901 . . . . 0.0 111.834 172.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -65.87 -22.08 66.5 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 122.736 0.415 . . . . 0.0 111.847 -173.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 44.7 mm-40 -75.68 -7.52 54.53 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.692 0.397 . . . . 0.0 111.819 178.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 77.21 -63.74 3.23 Favored Glycine 0 CA--C 1.527 0.791 0 N-CA-C 110.302 -1.119 . . . . 0.0 110.302 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 60.4 t0 -78.08 65.32 3.45 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 170.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 60.8 pttt -69.34 12.18 0.19 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 125.474 1.51 . . . . 0.0 114.809 -169.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 19.9 t-160 -78.98 -23.87 44.2 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 124.691 1.196 . . . . 0.0 108.064 166.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 56.9 p -125.58 157.94 35.88 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 125.162 1.385 . . . . 0.0 111.968 -172.423 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.88 178.44 9.4 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 125.372 1.469 . . . . 0.0 107.703 168.109 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 4.3 m -135.5 173.31 11.86 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.412 0.685 . . . . 0.0 112.793 -170.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 37.2 ttmt -19.52 -68.86 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 130.44 3.496 . . . . 0.0 113.824 175.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 3.0 tppp? -56.08 -53.55 55.67 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.586 0.755 . . . . 0.0 109.959 -175.304 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -57.04 -41.71 79.15 Favored 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 123.516 0.726 . . . . 0.0 110.989 178.524 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 39.4 mt -61.47 -50.05 74.33 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 118.478 0.581 . . . . 0.0 111.212 178.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -59.55 -47.7 84.51 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 179.227 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -50.71 -55.91 14.42 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 123.314 0.646 . . . . 0.0 111.403 171.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 3.1 mt -45.43 -65.25 0.56 Allowed 'General case' 0 CA--C 1.521 -0.151 0 C-N-CA 124.514 1.126 . . . . 0.0 110.994 176.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 14.8 tt -61.19 -47.61 92.75 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 C-N-CA 120.056 -0.658 . . . . 0.0 109.827 -173.124 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -53.94 -50.12 67.16 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.016 0.926 . . . . 0.0 111.866 -178.948 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 50.9 mtmt -76.21 -49.48 17.04 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 122.359 0.264 . . . . 0.0 111.076 -176.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 74.7 mm-40 -78.02 -32.44 51.04 Favored 'General case' 0 N--CA 1.453 -0.287 0 CA-C-O 118.533 -0.746 . . . . 0.0 112.795 -169.215 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 48.7 mt -91.54 91.61 8.13 Favored 'General case' 0 C--N 1.338 0.089 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 169.013 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 62.2 p -75.83 62.76 1.59 Allowed 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 124.49 1.116 . . . . 0.0 108.867 178.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 64.7 mt -92.68 -65.08 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.448 0 C-N-CA 124.703 1.201 . . . . 0.0 108.284 -176.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.68 -67.53 0.78 Allowed Glycine 0 CA--C 1.53 1.004 0 N-CA-C 110.305 -1.118 . . . . 0.0 110.305 -174.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 19.8 m -67.3 75.74 0.15 Allowed 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 125.139 1.375 . . . . 0.0 109.707 170.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . 0.485 ' HB3' HD11 ' B' ' 53' ' ' ILE . 35.2 mmtp -39.62 93.28 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 127.012 2.125 . . . . 0.0 112.377 -177.777 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 90.5 mt -42.57 -54.99 3.7 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 125.62 1.568 . . . . 0.0 113.019 -173.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -162.34 157.76 23.15 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 107.538 -1.282 . . . . 0.0 107.538 -174.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -32.62 -45.5 0.12 Allowed 'General case' 0 C--O 1.226 -0.149 0 C-N-CA 128.511 2.724 . . . . 0.0 113.886 -173.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -30.3 -55.7 0.19 Allowed 'General case' 0 C--O 1.227 -0.102 0 C-N-CA 125.907 1.683 . . . . 0.0 113.695 178.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -66.1 -42.17 89.63 Favored 'General case' 0 CA--C 1.53 0.182 0 CA-C-O 121.069 0.461 . . . . 0.0 110.701 -174.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 53' ' ' ILE . . . . . 0.558 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.1 mp -61.26 -52.97 55.22 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 N-CA-C 106.636 -1.616 . . . . 0.0 106.636 179.292 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 69.9 t -57.08 -43.72 81.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.482 0 C-N-CA 124.362 1.065 . . . . 0.0 110.233 -178.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -55.92 -54.78 40.56 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 119.418 1.008 . . . . 0.0 110.497 172.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 43.5 mt -53.36 -42.09 66.49 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-O 119.04 -0.505 . . . . 0.0 111.359 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 22.9 mmt -68.76 -61.86 1.63 Allowed 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 118.741 0.701 . . . . 0.0 109.613 177.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -40.94 -46.98 2.92 Favored 'General case' 0 CA--C 1.516 -0.333 0 C-N-CA 127.626 2.37 . . . . 0.0 111.113 -177.455 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -39.71 -49.22 2.26 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 124.071 0.949 . . . . 0.0 112.513 177.377 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 10.0 mp -59.74 -56.02 27.05 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -177.268 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -61.27 -40.87 95.7 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 123.444 0.698 . . . . 0.0 111.245 -178.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 52.5 ttt180 -62.94 -50.54 70.4 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 124.035 0.934 . . . . 0.0 109.798 -178.559 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 -73.71 -50.33 21.36 Favored 'General case' 0 C--O 1.227 -0.082 0 N-CA-C 110.586 -0.153 . . . . 0.0 110.586 -176.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 50.9 mttp 62.69 -80.98 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.498 1.119 . . . . 0.0 108.938 -168.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -153.49 36.8 0.46 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 126.301 1.84 . . . . 0.0 108.866 170.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 31.9 mt-30 -124.26 139.01 54.32 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 125.588 1.555 . . . . 0.0 108.031 -175.592 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -68.54 159.0 32.7 Favored 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 123.852 0.861 . . . . 0.0 110.378 174.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 12.0 m -115.67 148.03 18.67 Favored 'Isoleucine or valine' 0 C--O 1.235 0.303 0 N-CA-C 107.062 -1.459 . . . . 0.0 107.062 168.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -89.39 177.6 6.54 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.542 0.737 . . . . 0.0 111.287 175.251 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 68.9 t80 -47.35 -60.02 2.8 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 123.623 0.769 . . . . 0.0 111.94 175.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 40.3 tp60 -58.9 -37.93 77.75 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-N 119.218 0.917 . . . . 0.0 111.264 -176.029 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -63.26 -42.79 99.18 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.502 -0.749 . . . . 0.0 111.032 176.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -55.67 -48.59 74.79 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.64 -0.663 . . . . 0.0 109.915 170.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 28.0 mm -59.05 -32.47 47.89 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.418 0 O-C-N 121.601 -0.687 . . . . 0.0 110.76 175.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 23.4 m -66.37 -41.75 88.99 Favored 'General case' 0 C--O 1.225 -0.189 0 O-C-N 121.265 -0.897 . . . . 0.0 109.822 174.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 27.7 t80 -56.3 -52.92 62.74 Favored 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 109.744 -0.465 . . . . 0.0 109.744 174.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 49.2 mt -60.07 -46.13 90.59 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 120.933 0.397 . . . . 0.0 111.664 177.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.28 -39.2 97.58 Favored Glycine 0 CA--C 1.525 0.662 0 N-CA-C 110.948 -0.861 . . . . 0.0 110.948 -176.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.33 -47.14 77.54 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 123.431 0.692 . . . . 0.0 110.175 174.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 14.5 tp -51.33 -54.36 27.03 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 109.375 -0.602 . . . . 0.0 109.375 175.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.83 -57.33 9.65 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 114.872 -1.058 . . . . 0.0 109.995 177.532 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 49.5 ttm -48.09 -51.14 25.74 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.785 0.834 . . . . 0.0 110.755 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 33.6 mt -69.91 -48.49 63.28 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 CA-C-O 117.859 -1.067 . . . . 0.0 111.201 -172.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.426 0.0 OUTLIER -87.99 -34.74 17.94 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 115.157 1.54 . . . . 0.0 115.157 -176.593 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 33.4 m120 -80.0 68.6 6.16 Favored 'General case' 0 CA--C 1.529 0.149 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 172.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -33.55 -43.79 0.13 Allowed 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 127.725 2.41 . . . . 0.0 114.364 -174.136 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -40.5 -41.5 1.44 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.572 1.549 . . . . 0.0 113.038 176.266 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 96.0 mt -62.4 -28.32 69.7 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -179.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 57.7 mtmt -89.06 -47.2 8.28 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 123.559 0.743 . . . . 0.0 109.401 172.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.143 0 CA-C-O 117.489 -1.728 . . . . 0.0 110.035 179.395 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.2 ttt . . . . . 0 N--CA 1.474 0.731 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -71.62 80.05 0.82 Allowed 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 122.88 0.472 . . . . 0.0 110.892 -175.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -54.86 161.57 2.25 Favored Pre-proline 0 CA--C 1.542 0.636 0 C-N-CA 124.012 0.925 . . . . 0.0 111.093 173.192 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -48.94 -49.26 15.59 Favored 'Trans proline' 0 N--CA 1.458 -0.592 0 C-N-CA 123.009 2.472 . . . . 0.0 112.424 177.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 5' ' ' LEU . 6.6 mt -58.45 -45.54 88.35 Favored 'General case' 0 C--O 1.223 -0.309 0 CA-C-O 118.985 -0.531 . . . . 0.0 111.013 175.484 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -57.86 -46.09 85.33 Favored 'General case' 0 C--O 1.227 -0.111 0 CA-C-N 118.771 0.714 . . . . 0.0 109.758 -178.601 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 12.5 tp60 -61.17 -49.07 78.71 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 122.05 0.14 . . . . 0.0 111.052 177.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.12 -46.91 79.06 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 121.503 0.668 . . . . 0.0 111.474 -175.637 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 76.9 mt -53.74 -53.56 25.53 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.233 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 170.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -45.96 -47.41 14.53 Favored Glycine 0 CA--C 1.528 0.857 0 C-N-CA 124.78 1.181 . . . . 0.0 111.807 175.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.2 mt -55.94 -57.18 13.2 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.22 0.608 . . . . 0.0 110.963 173.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.5 mp -57.44 -43.78 84.17 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 119.26 0.937 . . . . 0.0 111.899 -178.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 63.6 mt -55.01 -57.93 5.61 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 C-N-CA 123.627 0.771 . . . . 0.0 109.814 172.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -53.72 -49.95 55.93 Favored Glycine 0 CA--C 1.522 0.518 0 N-CA-C 110.411 -1.076 . . . . 0.0 110.411 -176.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 11.7 mm -52.62 -49.59 44.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 C-N-CA 123.581 0.752 . . . . 0.0 110.318 175.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 56.1 t80 -56.72 -57.42 12.5 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 118.307 0.503 . . . . 0.0 110.147 177.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -59.18 -37.09 76.54 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 123.549 0.74 . . . . 0.0 111.388 -172.763 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -46.64 -40.84 13.76 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 124.738 1.215 . . . . 0.0 111.41 178.22 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -96.55 -59.44 1.82 Allowed 'General case' 0 N--CA 1.456 -0.16 0 N-CA-C 108.871 -0.788 . . . . 0.0 108.871 176.686 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.4 m -47.87 -42.25 26.28 Favored 'General case' 0 CA--C 1.527 0.082 0 C-N-CA 123.984 0.914 . . . . 0.0 112.273 -171.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -38.77 -48.48 2.45 Favored Glycine 0 C--N 1.341 0.828 0 C-N-CA 124.606 1.098 . . . . 0.0 112.207 176.213 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.27 -30.98 71.51 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 122.821 0.449 . . . . 0.0 111.486 -172.319 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.2 mp0 -80.15 0.17 33.41 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 119.115 -0.469 . . . . 0.0 111.986 -176.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 78.06 -61.92 3.72 Favored Glycine 0 CA--C 1.527 0.827 0 CA-C-N 119.383 0.992 . . . . 0.0 110.825 174.091 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 55.8 t0 -78.38 60.49 2.59 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 107.693 -1.225 . . . . 0.0 107.693 170.222 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 23.5 pttm -69.62 8.62 0.62 Allowed 'General case' 0 N--CA 1.457 -0.104 0 C-N-CA 126.846 2.058 . . . . 0.0 114.333 -169.194 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 4.7 m80 -80.03 -19.43 47.69 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 126.172 1.789 . . . . 0.0 108.871 170.007 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.2 p -132.65 158.67 41.69 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 127.722 2.409 . . . . 0.0 110.374 -177.202 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.34 178.61 9.42 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 125.471 1.509 . . . . 0.0 107.38 168.532 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 7.3 t -134.39 -168.5 2.15 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.462 1.028 . . . . 0.0 113.675 -174.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 21.2 pttt -48.81 -53.3 19.77 Favored 'General case' 0 C--O 1.228 -0.06 0 C-N-CA 126.146 1.778 . . . . 0.0 115.001 -168.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -54.05 -47.69 71.36 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 118.795 0.725 . . . . 0.0 109.961 179.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -63.03 -39.93 96.21 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 123.281 0.632 . . . . 0.0 110.79 178.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 5.1 mp -61.6 -49.08 78.03 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.901 0.773 . . . . 0.0 112.192 174.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -56.02 -47.79 77.16 Favored 'General case' 0 CA--C 1.53 0.178 0 N-CA-C 109.446 -0.575 . . . . 0.0 109.446 176.62 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -54.78 -57.04 13.13 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-O 119.148 -0.453 . . . . 0.0 111.168 173.232 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.6 mt -46.42 -60.49 2.31 Favored 'General case' 0 C--N 1.333 -0.136 0 C-N-CA 123.836 0.854 . . . . 0.0 110.333 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 13.5 tt -62.72 -50.86 78.03 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 C-N-CA 120.44 -0.504 . . . . 0.0 109.879 -176.034 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -59.94 -47.42 85.85 Favored 'General case' 0 CA--C 1.537 0.471 0 O-C-N 121.152 -0.967 . . . . 0.0 112.235 -175.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -76.13 -55.93 5.13 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.819 -0.551 . . . . 0.0 109.707 -177.356 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -84.77 -19.38 32.68 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 -168.194 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 30.3 mt -117.02 61.93 0.73 Allowed 'General case' 0 N--CA 1.461 0.096 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 169.328 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 64.5 p -34.89 -72.73 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 126.691 1.997 . . . . 0.0 112.169 -176.034 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 87.3 mt 64.44 -67.22 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 C-N-CA 127.002 2.121 . . . . 0.0 113.186 170.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.34 -65.47 1.31 Allowed Glycine 0 CA--C 1.529 0.919 0 N-CA-C 110.125 -1.19 . . . . 0.0 110.125 -171.079 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 17.5 m -68.14 74.81 0.22 Allowed 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 125.594 1.558 . . . . 0.0 111.019 175.283 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 41.5 mmtm -34.69 92.67 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 127.696 2.398 . . . . 0.0 112.331 -179.304 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 80.9 mt -59.78 109.77 1.0 Allowed 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.79 0.836 . . . . 0.0 113.114 -169.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 63.12 -77.36 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 126.163 1.785 . . . . 0.0 113.471 167.053 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -167.93 -47.43 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.173 0 C-N-CA 124.156 0.982 . . . . 0.0 109.59 -169.371 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -36.13 -58.99 0.64 Allowed 'General case' 0 N--CA 1.455 -0.179 0 C-N-CA 125.078 1.351 . . . . 0.0 112.581 -179.504 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 87.7 tt0 -61.4 -39.76 91.89 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 123.942 0.897 . . . . 0.0 111.388 -176.42 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.467 ' CD1' ' H ' ' A' ' 53' ' ' ILE . 0.9 OUTLIER -65.2 -54.58 27.36 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 106.45 -1.685 . . . . 0.0 106.45 -176.552 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 78.5 t -56.76 -42.18 76.79 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.492 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.046 177.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.8 mptp? -55.89 -54.31 46.24 Favored 'General case' 0 N--CA 1.456 -0.133 0 CA-C-N 119.091 0.86 . . . . 0.0 110.607 175.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 27.5 mt -53.26 -39.3 63.78 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-O 119.369 -0.348 . . . . 0.0 111.503 -179.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.89 -62.66 1.42 Allowed 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 118.537 0.608 . . . . 0.0 110.078 177.208 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -43.33 -40.14 3.45 Favored 'General case' 0 CA--C 1.523 -0.074 0 C-N-CA 127.062 2.145 . . . . 0.0 111.987 -178.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -39.81 -47.82 2.17 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.303 1.041 . . . . 0.0 112.736 173.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 6.8 mp -66.49 -34.15 77.28 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 122.898 0.479 . . . . 0.0 110.901 -179.011 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -74.41 -51.93 13.56 Favored 'General case' 0 N--CA 1.456 -0.128 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 -179.188 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 17.4 mtp85 -44.39 -56.29 4.34 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 123.624 0.77 . . . . 0.0 109.231 170.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -93.05 37.33 1.03 Allowed 'General case' 0 C--O 1.234 0.25 0 C-N-CA 122.964 0.506 . . . . 0.0 111.502 -178.274 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 20.0 ttmm -74.42 72.8 1.87 Allowed 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 172.28 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 69.92 42.2 1.06 Allowed 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 126.801 2.04 . . . . 0.0 111.648 -171.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -134.28 161.48 34.83 Favored 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 108.477 -0.935 . . . . 0.0 108.477 168.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 14.8 mt-10 -113.5 131.76 55.94 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 105.11 -2.182 . . . . 0.0 105.11 166.327 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 11.6 m -86.34 135.59 24.73 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 -178.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -79.8 171.03 15.67 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 123.731 0.812 . . . . 0.0 111.027 176.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -42.51 -59.52 1.85 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.502 0.721 . . . . 0.0 112.831 176.065 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.2 tp60 -63.85 -33.52 75.87 Favored 'General case' 0 CA--C 1.531 0.23 0 O-C-N 120.9 -1.125 . . . . 0.0 111.113 -175.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -64.81 -41.84 95.47 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 121.385 -0.822 . . . . 0.0 110.779 174.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -55.94 -50.59 70.35 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.414 -0.804 . . . . 0.0 109.38 170.242 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.1 mm -56.66 -37.94 55.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 O-C-N 121.922 -0.486 . . . . 0.0 110.451 176.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 33.2 m -62.63 -39.44 93.85 Favored 'General case' 0 C--O 1.226 -0.137 0 CA-C-N 118.95 0.796 . . . . 0.0 110.013 176.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 17.9 t80 -55.19 -53.97 49.22 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 173.004 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 53.5 mt -60.91 -45.16 95.74 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 122.04 -0.413 . . . . 0.0 112.017 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.35 -45.34 91.08 Favored Glycine 0 CA--C 1.524 0.616 0 N-CA-C 110.515 -1.034 . . . . 0.0 110.515 -176.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.51 -45.51 92.66 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 117.691 0.745 . . . . 0.0 110.187 175.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 12.7 tp -51.87 -56.02 16.55 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 118.488 0.585 . . . . 0.0 109.786 174.743 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.06 -53.32 34.86 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.332 1.053 . . . . 0.0 110.669 178.381 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 44.6 ttm -55.55 -50.76 69.18 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 125.082 1.353 . . . . 0.0 110.757 -179.05 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 62.8 mt -65.92 -53.34 39.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-O 118.454 -0.784 . . . . 0.0 110.265 -175.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.473 0.1 OUTLIER -74.54 -37.55 63.01 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-N 119.739 1.154 . . . . 0.0 113.126 -176.057 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 25.0 m-80 -82.66 61.55 5.82 Favored 'General case' 0 N--CA 1.465 0.311 0 N-CA-C 107.36 -1.348 . . . . 0.0 107.36 168.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -44.71 -37.06 3.46 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.88 1.272 . . . . 0.0 112.332 -174.518 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -31.96 -48.36 0.16 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 127.699 2.4 . . . . 0.0 113.306 169.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 46.2 mt -54.66 -33.25 60.45 Favored 'General case' 0 CA--C 1.529 0.148 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 -177.193 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 9.0 mtmp? -77.01 63.06 2.25 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 118.868 0.758 . . . . 0.0 111.72 -172.217 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.162 0 CA-C-O 117.3 -1.834 . . . . 0.0 111.025 172.929 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 26.9 ptm . . . . . 0 N--CA 1.471 0.607 0 N-CA-C 110.761 -0.088 . . . . 0.0 110.761 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -70.6 72.02 0.5 Allowed 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 123.895 0.878 . . . . 0.0 110.746 -178.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 10.5 m -62.76 163.5 15.62 Favored Pre-proline 0 CA--C 1.538 0.484 0 C-N-CA 125.871 1.668 . . . . 0.0 109.206 178.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -48.14 -48.33 16.92 Favored 'Trans proline' 0 N--CA 1.461 -0.436 0 C-N-CA 122.921 2.414 . . . . 0.0 113.006 -176.521 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.8 mt -53.73 -52.54 59.81 Favored 'General case' 0 C--O 1.225 -0.192 0 N-CA-C 111.778 0.288 . . . . 0.0 111.778 172.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -61.57 -38.74 88.62 Favored 'General case' 0 C--O 1.226 -0.18 0 CA-C-N 118.063 0.392 . . . . 0.0 110.565 -176.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.2 tp-100 -62.82 -50.9 69.16 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.291 0.636 . . . . 0.0 110.213 176.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.67 -45.93 91.89 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.44 0.638 . . . . 0.0 111.193 -179.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 67.4 mt -53.44 -51.24 43.33 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 170.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -48.59 -47.73 29.38 Favored Glycine 0 CA--C 1.525 0.713 0 C-N-CA 125.359 1.456 . . . . 0.0 111.619 175.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 mt -54.88 -55.21 32.95 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 117.525 0.662 . . . . 0.0 110.651 173.137 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -57.07 -43.6 82.26 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.007 0.822 . . . . 0.0 111.616 179.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 94.6 mt -56.07 -55.55 17.76 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 C-N-CA 123.487 0.715 . . . . 0.0 110.091 173.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.09 -48.49 73.52 Favored Glycine 0 CA--C 1.523 0.588 0 N-CA-C 110.802 -0.919 . . . . 0.0 110.802 -178.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.5 mm -53.58 -47.53 60.35 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 C-N-CA 123.183 0.593 . . . . 0.0 110.011 175.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 25.7 t80 -56.36 -57.37 12.55 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 118.476 0.58 . . . . 0.0 109.543 175.048 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -52.49 -40.17 62.06 Favored 'General case' 0 N--CA 1.453 -0.305 0 C-N-CA 125.491 1.516 . . . . 0.0 112.113 -173.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 65.0 tttp -50.96 -34.71 29.98 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.128 1.371 . . . . 0.0 111.467 176.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 71.5 m-85 -101.96 -60.89 1.46 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.615 0.766 . . . . 0.0 110.806 179.103 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 5.0 p -80.39 -61.85 1.85 Allowed 'General case' 0 C--O 1.224 -0.246 0 C-N-CA 123.335 0.654 . . . . 0.0 110.743 -174.528 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -47.26 -37.12 10.98 Favored Glycine 0 CA--C 1.526 0.741 0 C-N-CA 125.425 1.488 . . . . 0.0 114.593 -169.074 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 25.4 pttm -65.13 -31.57 72.83 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 118.206 1.003 . . . . 0.0 112.609 177.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -75.03 161.26 29.6 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 124.538 1.135 . . . . 0.0 109.422 177.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -55.19 -47.2 75.64 Favored Glycine 0 CA--C 1.531 1.089 0 O-C-N 121.987 -0.446 . . . . 0.0 112.242 -178.326 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -79.79 60.81 3.54 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.84 0.856 . . . . 0.0 110.314 -177.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 24.5 mtmm -48.2 -33.59 8.76 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.379 1.072 . . . . 0.0 113.883 -169.539 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 9.5 t-80 -77.98 -10.83 59.78 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 112.935 0.717 . . . . 0.0 112.935 -172.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 4.8 p -136.58 162.46 33.06 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.898 0.879 . . . . 0.0 112.89 -168.195 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -161.34 174.24 13.81 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.695 1.198 . . . . 0.0 109.255 168.103 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -115.41 171.83 7.47 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.054 0.941 . . . . 0.0 112.832 -169.662 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 14.3 ptmt -35.93 -57.98 0.66 Allowed 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 127.521 2.328 . . . . 0.0 114.414 179.295 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.17 -45.43 87.49 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 122.805 0.442 . . . . 0.0 110.118 -178.144 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -62.87 -39.42 94.39 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 123.299 0.64 . . . . 0.0 110.936 177.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 5.9 mt -61.41 -49.82 75.31 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 119.096 0.862 . . . . 0.0 111.849 173.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 89.3 mttt -55.52 -46.84 76.98 Favored 'General case' 0 CA--C 1.531 0.219 0 O-C-N 122.114 -0.366 . . . . 0.0 110.266 176.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -54.62 -55.06 33.4 Favored 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 118.856 -0.592 . . . . 0.0 110.915 173.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 8.3 mt -46.38 -61.38 1.82 Allowed 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 123.295 0.638 . . . . 0.0 110.43 179.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 18.4 tt -59.62 -54.5 33.71 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 119.916 -0.713 . . . . 0.0 110.156 -176.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 21.7 tt0 -60.79 -46.11 91.79 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 118.606 0.639 . . . . 0.0 112.673 -173.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -74.8 -52.75 10.62 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.13 0.572 . . . . 0.0 109.626 -177.474 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 55.4 mm-40 -81.96 -27.52 33.21 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 113.068 0.766 . . . . 0.0 113.068 -167.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 41.0 mt -104.94 95.08 5.62 Favored 'General case' 0 CA--C 1.523 -0.083 0 N-CA-C 105.114 -2.18 . . . . 0.0 105.114 167.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 66.9 p -77.39 58.11 1.63 Allowed 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 124.366 1.066 . . . . 0.0 109.818 -172.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 65.6 mt -105.61 76.94 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.643 0 N-CA-C 106.544 -1.65 . . . . 0.0 106.544 -172.712 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -61.43 -53.12 46.71 Favored Glycine 0 CA--C 1.528 0.854 0 N-CA-C 108.632 -1.787 . . . . 0.0 108.632 169.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 6.7 m -66.96 80.4 0.12 Allowed 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.54 1.136 . . . . 0.0 109.97 171.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 43.8 mmtm -46.95 92.94 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.99 1.716 . . . . 0.0 111.359 177.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 95.0 mt -50.88 -53.99 27.75 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 124.419 1.088 . . . . 0.0 112.433 -170.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -162.72 155.51 19.36 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 107.839 -1.171 . . . . 0.0 107.839 -170.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -19.96 -51.16 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 129.798 3.239 . . . . 0.0 115.367 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.84 -60.97 0.16 Allowed 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 125.912 1.685 . . . . 0.0 113.35 179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 82.4 tt0 -66.15 -39.83 90.11 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-O 120.792 0.33 . . . . 0.0 110.954 -174.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 53' ' ' ILE . . . . . 0.478 ' H ' ' CD1' ' B' ' 53' ' ' ILE . 0.9 OUTLIER -61.06 -57.6 11.38 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 -177.937 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 52.5 t -57.77 -39.39 70.48 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 CA-C-N 115.01 -0.995 . . . . 0.0 110.187 -179.778 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -56.17 -52.14 65.45 Favored 'General case' 0 C--N 1.333 -0.112 0 CA-C-N 119.794 1.179 . . . . 0.0 111.229 174.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 68.1 mt -55.38 -40.54 71.48 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 119.345 -0.359 . . . . 0.0 111.205 -179.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.47 -60.69 2.1 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 118.839 0.745 . . . . 0.0 110.132 176.366 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -40.46 -46.13 2.37 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 127.369 2.268 . . . . 0.0 111.7 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -39.55 -48.23 2.02 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.449 1.1 . . . . 0.0 112.112 175.423 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 63.2 mt -57.9 -50.83 72.0 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 123.508 0.723 . . . . 0.0 110.017 -179.232 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -67.21 -41.16 86.23 Favored 'General case' 0 C--O 1.226 -0.15 0 C-N-CA 123.194 0.598 . . . . 0.0 111.067 -178.38 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 53.3 ttm-85 -60.01 -48.21 82.64 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.464 1.106 . . . . 0.0 109.977 -179.247 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -79.63 -48.32 13.95 Favored 'General case' 0 C--O 1.228 -0.051 0 CA-C-O 120.703 0.287 . . . . 0.0 111.316 -177.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 48.1 mttm 61.84 -87.56 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 124.788 1.235 . . . . 0.0 107.741 -167.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 24.4 m-20 -150.82 41.07 0.75 Allowed 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 125.511 1.524 . . . . 0.0 108.577 169.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 19.5 mm-40 -131.43 151.26 51.7 Favored 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 125.589 1.555 . . . . 0.0 107.392 172.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 44.9 mp0 -77.49 143.89 38.14 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 124.408 1.083 . . . . 0.0 109.874 -178.135 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 35.6 m -86.27 154.94 3.38 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 168.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 16.3 p30 -97.93 171.13 8.48 Favored 'General case' 0 CA--C 1.528 0.111 0 C-N-CA 124.797 1.239 . . . . 0.0 111.425 176.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -41.59 -60.98 1.16 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.402 1.081 . . . . 0.0 113.16 175.083 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 41.1 tp60 -63.51 -34.0 76.82 Favored 'General case' 0 C--O 1.225 -0.211 0 O-C-N 121.036 -1.04 . . . . 0.0 110.879 -175.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 54.7 mm-40 -63.01 -45.43 92.4 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 118.932 0.787 . . . . 0.0 111.17 173.225 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -53.67 -50.03 66.7 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.697 -0.627 . . . . 0.0 109.846 171.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 27.1 mm -58.01 -38.42 66.92 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.376 0 O-C-N 121.855 -0.528 . . . . 0.0 110.652 176.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 70.7 m -63.11 -41.71 99.4 Favored 'General case' 0 C--O 1.226 -0.174 0 O-C-N 121.506 -0.746 . . . . 0.0 109.972 176.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 23.1 t80 -56.37 -54.28 47.48 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 109.471 -0.566 . . . . 0.0 109.471 174.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 42.2 mt -58.82 -47.65 84.04 Favored 'General case' 0 CA--C 1.533 0.316 0 O-C-N 121.975 -0.453 . . . . 0.0 112.032 178.639 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.75 -43.94 97.02 Favored Glycine 0 CA--C 1.526 0.775 0 N-CA-C 110.87 -0.892 . . . . 0.0 110.87 -176.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.07 -48.26 79.42 Favored 'General case' 0 N--CA 1.451 -0.395 0 O-C-N 121.988 -0.713 . . . . 0.0 110.205 176.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -49.56 -56.83 8.53 Favored 'General case' 0 C--O 1.239 0.55 0 CA-C-O 121.864 0.84 . . . . 0.0 109.88 173.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.94 -54.54 23.37 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-N 114.612 -1.176 . . . . 0.0 110.376 179.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 19.7 ttp -62.4 -45.57 92.52 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 123.596 0.758 . . . . 0.0 111.648 -177.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 75.4 mt -60.66 -47.88 91.07 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-O 117.988 -1.006 . . . . 0.0 110.012 -177.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.484 0.0 OUTLIER -82.45 -34.16 28.25 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 114.476 1.287 . . . . 0.0 114.476 -179.926 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 33.4 m-80 -80.6 75.05 7.5 Favored 'General case' 0 N--CA 1.462 0.159 0 O-C-N 120.779 -1.201 . . . . 0.0 108.505 171.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 42.1 tt0 -40.41 -37.99 0.76 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.834 1.654 . . . . 0.0 112.977 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -39.93 -42.3 1.32 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 125.527 1.531 . . . . 0.0 113.46 173.33 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 93.9 mt -76.76 -12.34 59.97 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.763 0.825 . . . . 0.0 113.029 -176.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 9.9 mtmp? -100.41 -45.12 5.67 Favored 'General case' 0 CA--C 1.53 0.182 0 C-N-CA 124.334 1.054 . . . . 0.0 110.263 174.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.124 0 CA-C-O 117.484 -1.731 . . . . 0.0 110.273 -178.518 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.8 mtm . . . . . 0 N--CA 1.474 0.762 0 N-CA-C 110.778 -0.082 . . . . 0.0 110.778 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 48.3 68.74 0.64 Allowed 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 124.82 1.248 . . . . 0.0 111.972 179.075 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -50.32 158.33 1.03 Allowed Pre-proline 0 CA--C 1.54 0.586 0 C-N-CA 124.702 1.201 . . . . 0.0 111.541 177.314 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_exo -44.67 -49.89 8.89 Favored 'Trans proline' 0 N--CA 1.46 -0.491 0 C-N-CA 123.501 2.801 . . . . 0.0 113.404 -179.542 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.407 HD23 ' HA ' ' A' ' 5' ' ' LEU . 6.2 mt -55.9 -48.96 74.71 Favored 'General case' 0 C--O 1.226 -0.164 0 O-C-N 122.427 -0.17 . . . . 0.0 111.316 174.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -59.77 -46.9 87.75 Favored 'General case' 0 N--CA 1.455 -0.181 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 -177.376 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 12.2 tp60 -59.92 -47.27 86.47 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 122.505 0.322 . . . . 0.0 110.736 177.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.59 -46.04 77.25 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-O 121.091 0.472 . . . . 0.0 111.412 -176.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 77.9 mt -54.2 -50.66 54.06 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 170.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.46 -48.14 22.14 Favored Glycine 0 CA--C 1.528 0.89 0 C-N-CA 124.966 1.27 . . . . 0.0 111.893 174.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.9 mt -55.52 -56.8 16.02 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 117.71 0.755 . . . . 0.0 110.553 174.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.6 mp -57.98 -43.46 86.56 Favored 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 119.018 0.826 . . . . 0.0 111.752 -178.108 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 73.5 mt -55.48 -56.53 11.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 C-N-CA 124.03 0.932 . . . . 0.0 110.356 173.255 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.58 -49.33 65.74 Favored Glycine 0 CA--C 1.523 0.542 0 N-CA-C 110.544 -1.022 . . . . 0.0 110.544 -177.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 8.7 mm -54.03 -48.44 64.39 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.397 0 C-N-CA 123.674 0.79 . . . . 0.0 110.148 176.099 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 72.3 t80 -54.98 -61.4 2.33 Favored 'General case' 0 CA--C 1.529 0.146 0 CA-C-N 118.45 0.568 . . . . 0.0 109.525 176.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -53.42 -39.32 64.27 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.583 0.753 . . . . 0.0 111.633 -174.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -50.64 -36.77 37.01 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.842 0.857 . . . . 0.0 111.734 178.161 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 58.8 m-85 -101.12 -53.37 3.04 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.306 0.642 . . . . 0.0 110.028 -178.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m -54.82 -32.59 60.57 Favored 'General case' 0 CA--C 1.529 0.144 0 O-C-N 121.322 -0.861 . . . . 0.0 111.907 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -44.53 -34.14 3.49 Favored Glycine 0 CA--C 1.531 1.054 0 CA-C-O 118.74 -1.033 . . . . 0.0 113.528 173.113 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 5.7 ptmm? -104.54 29.54 6.06 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 118.581 1.19 . . . . 0.0 112.876 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -115.29 149.83 37.21 Favored 'General case' 0 C--O 1.225 -0.231 0 N-CA-C 107.442 -1.318 . . . . 0.0 107.442 169.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -53.9 -64.99 3.75 Favored Glycine 0 CA--C 1.529 0.964 0 N-CA-C 111.197 -0.761 . . . . 0.0 111.197 -175.214 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 46.9 t0 -79.92 86.0 5.48 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 107.465 -1.309 . . . . 0.0 107.465 169.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -57.05 -11.43 1.54 Allowed 'General case' 0 CA--C 1.539 0.523 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 -174.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 24.1 m80 -78.94 -5.07 52.82 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.094 0.957 . . . . 0.0 111.568 174.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 48.0 p -133.92 168.22 19.17 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.073 1.349 . . . . 0.0 109.379 -178.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -154.79 159.04 40.35 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 122.631 0.372 . . . . 0.0 111.463 169.617 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 81.0 p -103.38 167.12 10.01 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.782 0.833 . . . . 0.0 112.936 -169.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 17.0 pttm -32.98 -48.69 0.21 Allowed 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 127.158 2.183 . . . . 0.0 113.987 170.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.5 tmmm? -60.1 -52.23 66.25 Favored 'General case' 0 N--CA 1.453 -0.311 0 O-C-N 121.969 -0.457 . . . . 0.0 109.9 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 67.6 mm-40 -61.08 -36.35 79.41 Favored 'General case' 0 C--O 1.223 -0.311 0 CA-C-O 119.346 -0.359 . . . . 0.0 110.776 178.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 48.6 mt -67.99 -49.9 58.86 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 118.575 0.625 . . . . 0.0 111.659 179.498 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp -60.46 -39.71 88.56 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 121.912 -0.493 . . . . 0.0 109.972 176.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 97.3 mt-10 -56.88 -63.96 1.03 Allowed 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 169.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.7 mt -39.49 -58.64 1.23 Allowed 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 125.212 1.405 . . . . 0.0 112.266 -178.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 16.0 tt -58.61 -51.37 72.63 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 -177.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -59.26 -42.01 90.15 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 120.995 -1.065 . . . . 0.0 112.718 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.1 mmpt? -77.7 -49.53 14.27 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 125.256 1.423 . . . . 0.0 110.694 -170.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -102.77 -24.05 13.75 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 124.914 1.286 . . . . 0.0 112.709 -168.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 69.5 mt -110.7 60.57 0.61 Allowed 'General case' 0 CA--C 1.527 0.064 0 N-CA-C 107.384 -1.339 . . . . 0.0 107.384 169.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 32.3 p -51.11 -54.33 26.09 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.529 0.731 . . . . 0.0 109.831 -178.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 80.9 mt 61.4 -64.13 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 C-N-CA 126.906 2.082 . . . . 0.0 113.242 174.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.25 -66.87 1.86 Allowed Glycine 0 CA--C 1.525 0.672 0 N-CA-C 109.861 -1.295 . . . . 0.0 109.861 -177.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 10.0 m -68.13 74.88 0.22 Allowed 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 124.523 1.129 . . . . 0.0 109.509 170.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 30.4 mmtp -44.21 93.75 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 126.16 1.784 . . . . 0.0 110.799 179.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 91.3 mt -49.4 -58.77 4.53 Favored 'General case' 0 CA--C 1.529 0.139 0 C-N-CA 125.096 1.358 . . . . 0.0 112.609 -168.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -166.04 157.72 13.91 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 107.519 -1.289 . . . . 0.0 107.519 -175.304 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -30.25 -46.6 0.07 Allowed 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 128.901 2.881 . . . . 0.0 113.808 -174.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.27 -54.89 0.14 Allowed 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 125.948 1.699 . . . . 0.0 113.357 177.038 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 74.4 tt0 -67.29 -42.98 82.86 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.482 0.658 . . . . 0.0 111.031 -175.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.456 ' N ' HD12 ' A' ' 53' ' ' ILE . 1.1 mp -62.22 -50.6 79.33 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.42 0 N-CA-C 106.565 -1.643 . . . . 0.0 106.565 -178.242 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 77.1 t -54.09 -56.25 10.43 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.457 0 N-CA-C 109.09 -0.708 . . . . 0.0 109.09 176.422 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 9.9 mptt -45.23 -52.54 9.38 Favored 'General case' 0 C--O 1.232 0.15 0 C-N-CA 123.235 0.614 . . . . 0.0 112.317 -179.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 15.3 mt -50.07 -42.31 49.68 Favored 'General case' 0 CA--C 1.535 0.378 0 O-C-N 123.194 0.309 . . . . 0.0 111.815 -179.068 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 1.2 mpp? -81.39 -66.15 0.92 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.694 0.798 . . . . 0.0 109.642 179.149 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -40.29 -37.73 0.69 Allowed 'General case' 0 N--CA 1.461 0.093 0 C-N-CA 127.503 2.321 . . . . 0.0 112.789 -178.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -38.45 -53.37 1.55 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.939 0.896 . . . . 0.0 112.124 172.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -60.51 -37.1 80.04 Favored 'General case' 0 N--CA 1.456 -0.168 0 N-CA-C 110.564 -0.162 . . . . 0.0 110.564 -175.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -73.82 -51.53 16.03 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.624 0.77 . . . . 0.0 109.83 -177.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.7 -31.51 72.76 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 120.435 0.159 . . . . 0.0 111.001 -177.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -73.03 -68.03 0.52 Allowed 'General case' 0 C--O 1.231 0.1 0 O-C-N 121.686 -0.634 . . . . 0.0 109.786 171.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt 62.44 -72.82 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 126.062 1.745 . . . . 0.0 109.332 -168.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 19.6 m-20 -131.88 -18.24 2.72 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 125.674 1.59 . . . . 0.0 111.869 172.925 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 19.0 tt0 -67.87 110.7 3.96 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.564 0.746 . . . . 0.0 110.823 -173.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 51.6 mp0 -68.23 114.86 7.07 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 105.429 -2.063 . . . . 0.0 105.429 167.102 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 3.0 m -79.05 138.03 20.78 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 N-CA-C 108.582 -0.896 . . . . 0.0 108.582 -169.707 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -79.82 171.89 14.51 Favored 'General case' 0 C--O 1.231 0.113 0 C-N-CA 122.685 0.394 . . . . 0.0 110.577 176.465 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 70.6 t80 -43.95 -56.93 3.61 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.623 0.769 . . . . 0.0 112.673 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 34.8 tp60 -63.73 -33.71 76.25 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 120.968 -1.083 . . . . 0.0 110.789 -176.025 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -66.62 -42.01 87.48 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 118.761 0.709 . . . . 0.0 110.641 176.358 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -54.69 -48.59 72.25 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 121.653 -0.654 . . . . 0.0 109.813 169.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.449 ' CG2' ' CG2' ' B' ' 74' ' ' ILE . 24.4 mm -62.51 -29.75 47.56 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.644 0 O-C-N 121.828 -0.545 . . . . 0.0 111.275 175.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 39.1 m -68.23 -43.7 77.35 Favored 'General case' 0 C--O 1.225 -0.205 0 O-C-N 120.922 -1.112 . . . . 0.0 109.496 173.739 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 58.1 t80 -56.28 -58.06 9.6 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 175.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 71.1 mt -61.3 -44.48 97.15 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 122.101 -0.374 . . . . 0.0 111.79 179.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.78 -44.03 95.37 Favored Glycine 0 CA--C 1.527 0.811 0 N-CA-C 111.071 -0.812 . . . . 0.0 111.071 -176.704 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.12 -47.92 75.46 Favored 'General case' 0 N--CA 1.453 -0.316 0 CA-C-N 117.798 0.799 . . . . 0.0 109.938 176.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 37.6 tp -47.11 -57.31 5.23 Favored 'General case' 0 C--O 1.238 0.454 0 CA-C-O 121.786 0.803 . . . . 0.0 110.226 172.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -53.38 -49.51 67.06 Favored 'General case' 0 N--CA 1.447 -0.59 0 CA-C-N 114.633 -1.167 . . . . 0.0 110.904 177.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 44.9 ttm -57.68 -51.23 70.37 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.171 0.988 . . . . 0.0 110.689 -179.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 65.4 mt -61.32 -50.71 79.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.273 0 CA-C-O 118.287 -0.863 . . . . 0.0 109.577 -176.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.431 1.7 p90 -72.89 -40.79 65.3 Favored 'General case' 0 C--N 1.347 0.469 0 C-N-CA 118.818 -1.153 . . . . 0.0 113.301 -177.464 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 43.7 m-80 -78.81 74.85 5.33 Favored 'General case' 0 N--CA 1.462 0.135 0 O-C-N 121.077 -1.015 . . . . 0.0 108.634 172.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -39.56 -41.55 1.03 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 125.525 1.53 . . . . 0.0 113.074 -179.187 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -38.37 -46.41 1.12 Allowed 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.349 1.46 . . . . 0.0 112.885 173.114 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.0 mt -72.16 6.11 2.39 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.315 1.046 . . . . 0.0 113.367 -175.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt -111.73 3.68 17.95 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 124.218 1.007 . . . . 0.0 110.63 169.088 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.201 0 CA-C-O 117.29 -1.839 . . . . 0.0 110.231 -179.217 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 76.0 mtp . . . . . 0 N--CA 1.474 0.742 0 CA-C-O 120.547 0.213 . . . . 0.0 110.476 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.14 73.53 3.72 Favored 'General case' 0 CA--C 1.531 0.249 0 O-C-N 122.164 -0.335 . . . . 0.0 110.633 -178.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 2.9 m -52.83 159.41 1.81 Allowed Pre-proline 0 CA--C 1.542 0.655 0 C-N-CA 123.56 0.744 . . . . 0.0 110.976 171.609 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_exo -49.02 -50.08 13.66 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 123.067 2.512 . . . . 0.0 113.099 -177.255 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.3 mt -55.56 -45.07 77.33 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 112.018 0.377 . . . . 0.0 112.018 173.117 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -64.21 -38.57 91.52 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 118.35 0.523 . . . . 0.0 109.868 -176.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 14.2 tp60 -64.43 -46.75 81.87 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.542 0.337 . . . . 0.0 110.838 174.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.39 -47.87 80.24 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.539 0.685 . . . . 0.0 110.989 -178.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 74.6 mt -53.35 -51.95 36.19 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 169.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.66 -43.48 21.99 Favored Glycine 0 CA--C 1.526 0.773 0 C-N-CA 125.717 1.627 . . . . 0.0 112.109 175.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 mt -59.38 -54.15 50.04 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 117.704 0.752 . . . . 0.0 110.598 173.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.7 mp -58.23 -43.66 87.85 Favored 'General case' 0 CA--C 1.539 0.528 0 CA-C-N 118.814 0.734 . . . . 0.0 111.341 179.197 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 76.3 mt -56.03 -55.93 15.63 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.157 0 C-N-CA 123.825 0.85 . . . . 0.0 109.921 173.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -53.97 -50.61 54.22 Favored Glycine 0 CA--C 1.521 0.445 0 N-CA-C 110.023 -1.231 . . . . 0.0 110.023 -177.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 8.6 mm -53.0 -48.88 51.55 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 C-N-CA 123.508 0.723 . . . . 0.0 110.586 175.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -57.24 -60.99 2.79 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.949 0.404 . . . . 0.0 109.953 177.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -52.07 -40.63 61.48 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 125.418 1.487 . . . . 0.0 111.564 -174.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -46.36 -34.6 4.72 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.538 1.535 . . . . 0.0 111.623 179.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 85.4 m-85 -110.71 -50.15 2.98 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 122.817 0.447 . . . . 0.0 110.786 177.274 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 12.4 p -55.16 -38.05 67.78 Favored 'General case' 0 C--O 1.227 -0.104 0 C-N-CA 123.427 0.691 . . . . 0.0 111.126 -174.56 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -47.96 -30.5 7.24 Favored Glycine 0 CA--C 1.53 0.995 0 C-N-CA 124.431 1.015 . . . . 0.0 113.413 177.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 8.6 mtmp? -78.73 -27.76 44.9 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 118.045 0.923 . . . . 0.0 112.137 -178.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 49.9 mm-40 -73.58 146.65 44.56 Favored 'General case' 0 N--CA 1.452 -0.331 0 N-CA-C 109.143 -0.688 . . . . 0.0 109.143 -176.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -48.55 -56.09 10.05 Favored Glycine 0 CA--C 1.529 0.936 0 C-N-CA 123.479 0.561 . . . . 0.0 112.057 -173.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 52.2 t0 -85.14 84.27 7.75 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 172.437 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 25.2 mmtm -40.0 -40.54 1.06 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 126.212 1.805 . . . . 0.0 114.295 -169.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 17.7 p-80 -80.98 12.13 3.54 Favored 'General case' 0 CA--C 1.536 0.412 0 N-CA-C 113.953 1.094 . . . . 0.0 113.953 -176.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 32.6 p -132.49 164.41 26.64 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 123.947 0.899 . . . . 0.0 109.739 176.333 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -160.21 167.21 28.12 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 122.771 0.428 . . . . 0.0 110.936 169.736 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 46.7 m -113.71 170.09 8.5 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.923 1.289 . . . . 0.0 113.449 -169.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -32.2 -52.23 0.27 Allowed 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 128.299 2.64 . . . . 0.0 115.265 178.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -59.03 -59.29 5.7 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.609 -0.886 . . . . 0.0 108.609 -178.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -52.48 -39.88 61.69 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 123.521 0.728 . . . . 0.0 111.37 177.052 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 54.3 mt -65.05 -51.31 62.25 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 118.8 0.727 . . . . 0.0 112.079 179.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 8.2 mtmp? -61.77 -45.3 94.48 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 121.662 -0.649 . . . . 0.0 109.908 178.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -49.93 -56.91 8.74 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 123.45 0.7 . . . . 0.0 110.512 169.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 4.1 mt -45.5 -61.79 1.54 Allowed 'General case' 0 CA--C 1.521 -0.173 0 C-N-CA 124.351 1.06 . . . . 0.0 110.416 177.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 2.8 tp -60.55 -49.25 85.16 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 -173.376 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 -55.17 -48.55 73.62 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.302 1.041 . . . . 0.0 111.838 -178.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 8.5 mtmp? -76.66 -53.11 8.45 Favored 'General case' 0 N--CA 1.454 -0.226 0 CA-C-O 120.914 0.388 . . . . 0.0 111.264 -176.311 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -78.89 -26.47 43.86 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 113.435 0.902 . . . . 0.0 113.435 -167.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 49.9 mt -102.63 94.27 5.55 Favored 'General case' 0 N--CA 1.456 -0.132 0 N-CA-C 106.438 -1.69 . . . . 0.0 106.438 167.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 70.9 p -77.98 57.72 1.81 Allowed 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.62 0.768 . . . . 0.0 109.043 -177.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 45.6 mt -85.0 -60.2 2.34 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 C-N-CA 124.55 1.14 . . . . 0.0 107.925 -175.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 69.75 -70.38 0.56 Allowed Glycine 0 CA--C 1.529 0.906 0 N-CA-C 110.327 -1.109 . . . . 0.0 110.327 -176.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 20.1 m -66.05 79.32 0.09 Allowed 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 125.443 1.497 . . . . 0.0 109.59 171.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . 0.441 ' HB3' HD11 ' B' ' 53' ' ' ILE . 39.6 mmtm -42.4 93.15 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 126.709 2.004 . . . . 0.0 112.127 -178.613 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 89.5 mt -44.96 -53.89 7.16 Favored 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 125.655 1.582 . . . . 0.0 113.017 -171.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.5 tm0? -161.91 158.49 25.4 Favored 'General case' 0 N--CA 1.45 -0.464 0 N-CA-C 107.215 -1.402 . . . . 0.0 107.215 -172.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -32.69 -44.16 0.1 Allowed 'General case' 0 C--O 1.225 -0.235 0 C-N-CA 128.62 2.768 . . . . 0.0 114.203 -173.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.84 -59.69 0.17 Allowed 'General case' 0 CA--C 1.527 0.096 0 C-N-CA 125.882 1.673 . . . . 0.0 113.732 178.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 74.1 tt0 -65.86 -38.44 88.83 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.742 0.306 . . . . 0.0 110.695 -173.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 53' ' ' ILE . . . . . 0.524 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.1 mp -63.5 -53.43 45.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 N-CA-C 106.893 -1.521 . . . . 0.0 106.893 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 78.8 t -56.02 -44.36 78.19 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.401 0 C-N-CA 124.226 1.011 . . . . 0.0 110.04 179.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -56.1 -53.91 51.38 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 118.779 0.718 . . . . 0.0 110.759 173.117 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 66.6 mt -53.56 -41.29 66.33 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 119.082 -0.485 . . . . 0.0 111.374 178.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 25.9 mmt -67.57 -61.36 1.93 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 118.896 0.771 . . . . 0.0 109.646 176.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -42.8 -43.88 4.19 Favored 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 127.441 2.296 . . . . 0.0 111.437 -177.731 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -39.64 -48.66 2.14 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 124.397 1.079 . . . . 0.0 112.302 176.115 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 10.2 mp -63.02 -48.59 78.11 Favored 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 -176.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -62.83 -45.32 93.17 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 122.825 0.45 . . . . 0.0 110.606 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 45.4 ttm-85 -55.73 -51.95 65.59 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 123.6 0.76 . . . . 0.0 109.198 176.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -84.32 59.74 5.57 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 123.079 0.552 . . . . 0.0 110.586 -176.675 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 4.5 mtmp? -71.83 73.68 0.84 Allowed 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 108.945 -0.761 . . . . 0.0 108.945 169.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 44.3 m-20 50.69 50.71 18.4 Favored 'General case' 0 CA--C 1.527 0.085 0 C-N-CA 125.497 1.519 . . . . 0.0 110.953 179.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -150.03 144.12 25.59 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 107.274 -1.38 . . . . 0.0 107.274 177.473 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -80.5 132.87 35.75 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 174.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 5.6 m -78.98 140.93 16.1 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 174.67 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 18.6 p30 -82.89 172.82 12.41 Favored 'General case' 0 C--O 1.231 0.131 0 C-N-CA 123.556 0.742 . . . . 0.0 110.902 175.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -44.34 -60.18 2.05 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.001 0.92 . . . . 0.0 112.56 176.049 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 50.4 tp60 -62.72 -35.51 79.98 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 119.381 0.991 . . . . 0.0 110.925 -175.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 57.9 mm-40 -60.82 -47.75 84.91 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 119.032 0.833 . . . . 0.0 111.094 173.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -53.25 -49.22 67.32 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 122.004 -0.435 . . . . 0.0 110.145 172.549 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 0.449 ' CG2' ' CG2' ' A' ' 74' ' ' ILE . 29.8 mm -57.83 -39.21 69.94 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 O-C-N 121.735 -0.603 . . . . 0.0 110.66 176.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 57.8 m -63.87 -41.09 97.83 Favored 'General case' 0 C--O 1.227 -0.125 0 O-C-N 121.587 -0.695 . . . . 0.0 110.106 177.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 32.0 t80 -54.32 -53.16 57.64 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 173.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 75.9 mt -62.4 -42.28 99.31 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 178.53 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -66.32 -42.39 94.07 Favored Glycine 0 CA--C 1.527 0.798 0 N-CA-C 110.718 -0.953 . . . . 0.0 110.718 -177.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.6 -46.76 88.45 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 123.41 0.684 . . . . 0.0 109.886 174.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 10.2 tp -51.51 -54.59 25.63 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 109.478 -0.564 . . . . 0.0 109.478 174.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -53.08 -52.5 58.38 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.899 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 28.8 mtt -50.7 -55.69 15.4 Favored 'General case' 0 CA--C 1.526 0.049 0 C-N-CA 123.825 0.85 . . . . 0.0 111.347 174.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 49.0 mt -63.12 -47.37 92.8 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.327 0 CA-C-O 118.105 -0.95 . . . . 0.0 110.433 -169.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.475 0.0 OUTLIER -83.48 -39.69 20.18 Favored 'General case' 0 C--N 1.347 0.463 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 179.818 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 16.4 m-80 -82.37 65.98 7.75 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 107.294 -1.373 . . . . 0.0 107.294 169.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -43.96 -37.86 3.15 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.543 1.137 . . . . 0.0 112.701 -174.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.27 -48.46 0.23 Allowed 'General case' 0 C--O 1.225 -0.22 0 C-N-CA 127.024 2.13 . . . . 0.0 113.346 169.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 97.3 mt -63.67 -33.32 75.38 Favored 'General case' 0 CA--C 1.528 0.104 0 N-CA-C 112.573 0.583 . . . . 0.0 112.573 -176.356 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 29.7 mtmm -81.93 -43.18 18.44 Favored 'General case' 0 N--CA 1.455 -0.206 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 174.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.175 0 CA-C-O 117.17 -1.905 . . . . 0.0 110.712 -175.019 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.734 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -78.86 68.62 4.86 Favored 'General case' 0 C--O 1.234 0.259 0 O-C-N 122.089 -0.382 . . . . 0.0 111.317 -175.118 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.4 m -52.67 157.91 2.39 Favored Pre-proline 0 CA--C 1.534 0.353 0 C-N-CA 123.991 0.916 . . . . 0.0 110.266 172.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_exo -40.09 -52.03 2.98 Favored 'Trans proline' 0 N--CA 1.459 -0.511 0 C-N-CA 124.038 3.158 . . . . 0.0 113.82 -179.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 5' ' ' LEU . 5.6 mt -54.05 -60.41 3.36 Favored 'General case' 0 C--O 1.225 -0.207 0 N-CA-C 112.122 0.416 . . . . 0.0 112.122 173.773 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -55.77 -40.11 72.14 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-O 121.004 0.43 . . . . 0.0 110.708 -175.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -64.96 -51.63 60.72 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.356 1.062 . . . . 0.0 110.144 -179.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -59.05 -46.77 87.4 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.221 1.008 . . . . 0.0 110.901 178.453 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 69.1 mt -51.94 -55.07 10.83 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 170.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.23 -47.88 20.95 Favored Glycine 0 CA--C 1.527 0.834 0 C-N-CA 125.148 1.356 . . . . 0.0 112.033 176.372 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.9 mt -55.0 -53.43 55.85 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.612 0.765 . . . . 0.0 110.986 174.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -59.33 -45.0 92.54 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 121.582 -0.699 . . . . 0.0 111.792 179.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.479 HD11 ' HB1' ' B' ' 81' ' ' ALA . 83.9 mt -55.72 -55.6 16.75 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.263 0 C-N-CA 123.714 0.806 . . . . 0.0 109.819 175.177 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -52.74 -51.97 41.32 Favored Glycine 0 CA--C 1.521 0.447 0 N-CA-C 109.724 -1.35 . . . . 0.0 109.724 -177.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.44 HG21 HD11 ' B' ' 5' ' ' LEU . 3.2 mm -56.71 -47.31 82.7 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 CA-C-O 119.332 -0.366 . . . . 0.0 110.634 179.057 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.4 ' HB2' ' CE2' ' A' ' 73' ' ' TYR . 73.7 t80 -53.03 -60.44 3.29 Favored 'General case' 0 C--N 1.339 0.14 0 CA-C-N 118.126 0.421 . . . . 0.0 110.055 175.388 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -60.55 -34.69 74.52 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-O 118.987 -0.53 . . . . 0.0 111.19 -171.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.3 ttpp -52.72 -37.9 59.92 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.134 0.574 . . . . 0.0 111.442 -179.258 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 88.8 m-85 -97.27 -58.48 2.0 Favored 'General case' 0 C--O 1.227 -0.116 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 175.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.8 t -50.05 -35.7 26.12 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.369 1.068 . . . . 0.0 111.733 -173.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -39.83 -39.05 1.27 Allowed Glycine 0 CA--C 1.53 0.982 0 C-N-CA 125.362 1.458 . . . . 0.0 114.336 172.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 41.8 pttt -76.72 -18.78 58.3 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.271 1.035 . . . . 0.0 112.818 -174.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 60.1 mm-40 -76.25 148.61 37.49 Favored 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 179.292 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -55.21 -64.09 4.68 Favored Glycine 0 CA--C 1.528 0.86 0 N-CA-C 110.624 -0.99 . . . . 0.0 110.624 -178.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -79.34 75.47 5.92 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 107.094 -1.447 . . . . 0.0 107.094 169.507 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -54.34 -13.72 0.98 Allowed 'General case' 0 CA--C 1.534 0.34 0 N-CA-C 115.022 1.489 . . . . 0.0 115.022 -172.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 9.9 m80 -77.81 -6.04 52.82 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.333 1.053 . . . . 0.0 110.708 176.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 31.6 p -134.5 161.8 34.04 Favored 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 125.987 1.715 . . . . 0.0 109.64 -179.498 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -158.43 177.55 11.13 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 124.816 1.247 . . . . 0.0 108.059 174.028 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 8.5 t -139.13 -169.46 2.66 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 119.861 1.209 . . . . 0.0 112.282 -175.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 41.9 pttt -41.44 -54.07 3.2 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 127.279 2.231 . . . . 0.0 113.61 -169.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -53.62 -51.94 61.47 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.064 0.546 . . . . 0.0 110.267 179.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 14.6 mp0 -64.92 -41.87 95.19 Favored 'General case' 0 N--CA 1.45 -0.434 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 -178.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 41.8 mt -62.07 -47.38 84.91 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 118.544 0.611 . . . . 0.0 111.528 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 26.8 mtpp -61.51 -49.94 74.72 Favored 'General case' 0 CA--C 1.531 0.231 0 N-CA-C 109.664 -0.495 . . . . 0.0 109.664 176.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 78.3 tt0 -48.82 -54.89 13.32 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.168 0.987 . . . . 0.0 110.574 175.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.5 mt -48.41 -75.26 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 126.007 1.723 . . . . 0.0 109.022 174.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 15.6 tt -55.26 -47.05 78.16 Favored 'Isoleucine or valine' 0 C--N 1.341 0.235 0 CA-C-N 118.427 0.558 . . . . 0.0 111.268 -169.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 22.3 tt0 -52.23 -47.79 65.5 Favored 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 123.64 0.776 . . . . 0.0 111.37 -177.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 73.1 mttt -81.01 -62.58 1.62 Allowed 'General case' 0 CA--C 1.519 -0.229 0 CA-C-O 121.733 0.778 . . . . 0.0 109.506 -179.059 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -55.87 -36.33 67.47 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 114.842 -1.072 . . . . 0.0 111.882 -169.562 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 85.1 mt -119.28 62.25 0.8 Allowed 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 124.842 1.257 . . . . 0.0 107.743 171.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 7.4 t -69.23 53.47 0.1 Allowed 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.063 0.945 . . . . 0.0 110.848 169.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 62.8 mt -74.4 80.72 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 N-CA-C 106.917 -1.512 . . . . 0.0 106.917 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -49.83 -36.19 25.82 Favored Glycine 0 CA--C 1.53 0.977 0 C-N-CA 124.247 0.927 . . . . 0.0 111.842 176.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.7 m -61.45 -17.5 54.67 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 124.732 1.213 . . . . 0.0 113.946 176.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt 49.31 60.65 3.62 Favored 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 125.442 1.497 . . . . 0.0 111.007 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 56.8 mt -66.81 77.48 0.12 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.615 1.166 . . . . 0.0 111.687 -178.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? 83.09 151.01 0.09 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 126.961 2.104 . . . . 0.0 111.464 172.443 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -42.08 -39.55 2.0 Allowed 'General case' 0 CA--C 1.528 0.11 0 C-N-CA 127.822 2.449 . . . . 0.0 114.412 -169.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.84 -60.39 0.16 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.804 1.642 . . . . 0.0 114.1 -174.828 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -65.29 -42.68 92.89 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 122.958 0.503 . . . . 0.0 111.137 -175.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.545 HD12 ' H ' ' A' ' 53' ' ' ILE . 1.2 mp -60.01 -53.01 54.5 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 N-CA-C 106.876 -1.528 . . . . 0.0 106.876 -178.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 72.1 t -54.13 -55.35 14.81 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 CA-C-N 115.523 -0.762 . . . . 0.0 108.976 178.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -47.26 -54.48 10.78 Favored 'General case' 0 C--O 1.231 0.108 0 CA-C-N 118.489 0.586 . . . . 0.0 111.724 178.893 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 25.8 mt -51.55 -41.11 60.87 Favored 'General case' 0 CA--C 1.535 0.37 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 -177.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -80.79 -65.26 1.03 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.343 0.657 . . . . 0.0 110.37 178.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -37.91 -42.43 0.62 Allowed 'General case' 0 N--CA 1.463 0.177 0 C-N-CA 127.38 2.272 . . . . 0.0 112.139 179.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -38.22 -49.27 1.36 Allowed 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 124.671 1.188 . . . . 0.0 112.546 175.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.8 pp -58.73 -41.68 87.02 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 118.459 0.572 . . . . 0.0 111.148 -175.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -75.66 -46.28 32.3 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 123.661 0.784 . . . . 0.0 109.967 -178.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 59.7 ttm-85 -50.28 -47.78 55.21 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.831 0.852 . . . . 0.0 110.291 176.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 7.4 m-80 -75.91 -60.06 2.49 Favored 'General case' 0 CA--C 1.518 -0.26 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 -179.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 22.3 ttpp 48.11 48.37 18.44 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.695 0.76 . . . . 0.0 109.4 -170.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 69.41 -2.6 1.83 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.227 1.811 . . . . 0.0 114.405 -179.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 31.0 mt-30 -70.22 145.37 51.45 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.633 1.106 . . . . 0.0 108.895 173.273 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -85.92 119.79 26.62 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 108.465 -0.939 . . . . 0.0 108.465 172.039 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 8.6 m -79.65 145.63 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 172.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.9 p-10 -88.54 177.88 6.67 Favored 'General case' 0 C--O 1.231 0.086 0 C-N-CA 122.832 0.453 . . . . 0.0 110.825 175.192 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 59.5 t80 -42.6 -59.73 1.8 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.684 0.794 . . . . 0.0 112.241 172.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 61.6 tp60 -60.75 -37.0 80.34 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 119.294 0.952 . . . . 0.0 111.683 -175.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 75.2 mm-40 -67.97 -37.43 81.52 Favored 'General case' 0 CA--C 1.536 0.436 0 O-C-N 121.248 -0.908 . . . . 0.0 111.217 176.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.4 ' CE2' ' HB2' ' A' ' 16' ' ' PHE . 0.4 OUTLIER -58.0 -48.43 80.04 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.12 -0.988 . . . . 0.0 109.474 169.344 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 30.6 mm -58.76 -32.8 47.53 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 C-N-CA 123.171 0.589 . . . . 0.0 110.497 175.558 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 56.0 m -69.86 -38.96 76.6 Favored 'General case' 0 C--O 1.225 -0.216 0 O-C-N 121.504 -0.747 . . . . 0.0 110.621 174.052 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -59.16 -55.73 31.28 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 118.56 0.618 . . . . 0.0 109.366 174.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 32.1 mt -56.8 -46.61 81.46 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-O 120.711 0.291 . . . . 0.0 110.931 175.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -58.18 -44.3 94.93 Favored Glycine 0 CA--C 1.525 0.673 0 C-N-CA 124.346 0.974 . . . . 0.0 111.448 -178.11 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.58 -47.43 69.75 Favored 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 123.45 0.7 . . . . 0.0 109.899 178.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -49.98 -54.3 20.86 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-O 121.446 0.641 . . . . 0.0 109.565 173.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -53.15 -55.57 23.07 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 124.702 1.201 . . . . 0.0 110.968 177.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 40.2 ttm -52.33 -52.12 54.96 Favored 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 124.775 1.23 . . . . 0.0 110.524 179.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 56.6 mt -62.81 -51.68 68.95 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.377 0 CA-C-O 118.088 -0.958 . . . . 0.0 109.706 -172.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.427 0.0 OUTLIER -81.51 -32.31 32.42 Favored 'General case' 0 C--N 1.346 0.436 0 N-CA-C 114.667 1.358 . . . . 0.0 114.667 -176.392 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -80.36 76.48 7.17 Favored 'General case' 0 CA--C 1.521 -0.157 0 O-C-N 120.714 -1.242 . . . . 0.0 108.615 175.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 61.4 mm-40 -35.07 -49.83 0.48 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.522 1.529 . . . . 0.0 111.689 177.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -38.33 -43.78 0.84 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 126.893 2.077 . . . . 0.0 114.088 177.007 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 55.2 mt -61.96 -38.17 87.49 Favored 'General case' 0 N--CA 1.456 -0.158 0 CA-C-O 119.432 -0.318 . . . . 0.0 111.339 -178.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 9.8 mtmp? -79.87 55.06 1.99 Allowed 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 123.31 0.644 . . . . 0.0 111.635 -169.386 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.246 0 CA-C-O 116.731 -2.149 . . . . 0.0 110.107 176.245 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 28.0 ttt . . . . . 0 N--CA 1.474 0.758 0 CA-C-O 121.193 0.521 . . . . 0.0 110.045 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -73.02 78.6 1.19 Allowed 'General case' 0 N--CA 1.454 -0.241 0 CA-C-O 121.137 0.494 . . . . 0.0 110.581 -179.179 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 4.5 t -45.71 150.43 0.95 Allowed Pre-proline 0 CA--C 1.535 0.393 0 C-N-CA 124.292 1.037 . . . . 0.0 110.521 169.316 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo -43.56 -42.73 11.19 Favored 'Trans proline' 0 N--CA 1.455 -0.783 0 C-N-CA 123.083 2.522 . . . . 0.0 112.097 168.596 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.44 HD11 HG21 ' A' ' 15' ' ' ILE . 5.0 mt -66.57 -43.06 86.0 Favored 'General case' 0 C--O 1.223 -0.331 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 174.134 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -57.07 -46.47 82.48 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 119.015 0.825 . . . . 0.0 109.407 177.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 -58.99 -52.73 64.49 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.57 0.748 . . . . 0.0 110.805 175.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.14 -46.76 85.73 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 123.301 0.64 . . . . 0.0 112.063 -175.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 73.9 mt -54.5 -53.21 32.95 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.199 0 N-CA-C 107.886 -1.154 . . . . 0.0 107.886 170.603 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.25 -46.27 15.99 Favored Glycine 0 CA--C 1.528 0.846 0 C-N-CA 124.64 1.114 . . . . 0.0 112.067 175.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 mt -58.23 -57.37 13.18 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.918 0.887 . . . . 0.0 110.918 174.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.07 -43.74 87.14 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 119.264 0.938 . . . . 0.0 111.669 -178.405 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 59.3 mt -56.35 -55.35 19.44 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.156 0 C-N-CA 123.623 0.769 . . . . 0.0 110.0 173.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.89 -49.15 63.28 Favored Glycine 0 CA--C 1.524 0.619 0 N-CA-C 110.566 -1.014 . . . . 0.0 110.566 -177.131 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 11.2 mm -53.06 -49.37 50.28 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 C-N-CA 123.454 0.701 . . . . 0.0 109.871 175.05 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 37.7 t80 -56.8 -52.43 65.07 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 121.805 -0.559 . . . . 0.0 110.768 176.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -58.57 -38.3 77.58 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 124.687 1.195 . . . . 0.0 111.106 -174.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 61.8 tttm -57.76 -25.82 60.99 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.933 1.293 . . . . 0.0 112.497 -179.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 56.2 m-85 -117.1 -62.22 1.61 Allowed 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.372 0.669 . . . . 0.0 109.903 -179.731 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -64.86 -48.93 72.53 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 124.164 0.985 . . . . 0.0 110.162 -176.6 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.89 56.6 3.9 Favored Glycine 0 C--N 1.339 0.712 0 C-N-CA 124.257 0.932 . . . . 0.0 111.969 -172.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 36.5 mtmt -146.47 -44.94 0.19 Allowed 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 127.556 2.343 . . . . 0.0 106.806 176.063 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 63.8 mt-10 -60.68 147.84 40.67 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 168.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -52.64 -43.44 59.48 Favored Glycine 0 CA--C 1.53 1.014 0 N-CA-C 111.517 -0.633 . . . . 0.0 111.517 -178.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -78.96 59.66 2.7 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.459 1.104 . . . . 0.0 110.134 177.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -50.51 -27.6 6.91 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.102 1.361 . . . . 0.0 113.791 -173.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 12.9 t-80 -76.92 -5.06 47.01 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.158 0.583 . . . . 0.0 111.976 -175.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -138.54 158.75 43.66 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 125.195 1.398 . . . . 0.0 111.316 -169.052 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.47 176.11 12.0 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 125.388 1.475 . . . . 0.0 108.212 171.397 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 7.3 t -135.59 -166.27 1.82 Allowed 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 119.731 1.151 . . . . 0.0 113.304 177.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 57.7 mtpt -38.67 -65.12 0.38 Allowed 'General case' 0 N--CA 1.458 -0.064 0 C-N-CA 128.19 2.596 . . . . 0.0 113.175 -169.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 36.3 ttpt -51.96 -50.3 61.49 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 123.465 0.706 . . . . 0.0 110.238 -175.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -61.36 -43.97 97.97 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 123.25 0.62 . . . . 0.0 110.15 -177.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 34.7 mt -62.4 -50.89 69.73 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 118.187 0.449 . . . . 0.0 111.546 177.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -61.93 -42.3 98.94 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 -178.211 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -56.42 -65.33 0.62 Allowed 'General case' 0 C--O 1.22 -0.476 0 CA-C-O 118.515 -0.755 . . . . 0.0 109.13 169.51 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 5.5 mt -35.04 -62.98 0.35 Allowed 'General case' 0 N--CA 1.462 0.173 0 C-N-CA 125.321 1.449 . . . . 0.0 111.687 -179.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 15.9 tt -60.49 -50.78 79.0 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 C-N-CA 120.297 -0.561 . . . . 0.0 110.306 -175.074 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 16.0 tt0 -62.11 -41.07 97.86 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 118.317 0.508 . . . . 0.0 112.151 -176.301 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 6.2 mmpt? -69.85 -54.13 14.92 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.637 1.175 . . . . 0.0 109.473 -177.306 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 69.0 mm-40 -83.43 -35.54 24.92 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 115.58 -0.736 . . . . 0.0 112.682 -167.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 47.1 mt -85.03 87.32 7.36 Favored 'General case' 0 C--N 1.339 0.14 0 CA-C-N 119.36 0.982 . . . . 0.0 108.809 170.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 64.2 p -78.62 55.61 1.68 Allowed 'General case' 0 CA--C 1.534 0.329 0 N-CA-C 109.061 -0.718 . . . . 0.0 109.061 177.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 55.3 mt -86.0 -59.0 3.0 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.238 0 C-N-CA 124.742 1.217 . . . . 0.0 108.763 -173.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.31 -65.68 1.29 Allowed Glycine 0 CA--C 1.53 0.981 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 -176.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 49.2 m -69.92 74.17 0.44 Allowed 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 124.145 0.978 . . . . 0.0 109.319 170.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 26.8 mtmm -47.7 96.31 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 125.983 1.713 . . . . 0.0 111.474 -178.569 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 72.5 mt -40.28 -46.7 2.35 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 126.806 2.043 . . . . 0.0 113.674 -173.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -157.95 170.0 23.3 Favored 'General case' 0 N--CA 1.449 -0.513 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 -178.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 12.1 p-10 -36.41 -42.45 0.33 Allowed 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 126.868 2.067 . . . . 0.0 113.095 173.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.35 -58.15 0.15 Allowed 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 126.541 1.936 . . . . 0.0 113.972 -178.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 65.0 tt0 -68.34 -40.41 81.57 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 121.066 0.46 . . . . 0.0 110.878 -172.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 53' ' ' ILE . . . . . 0.64 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.9 mp -62.99 -52.5 58.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 N-CA-C 106.865 -1.531 . . . . 0.0 106.865 179.378 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 72.0 t -54.85 -46.63 75.49 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 C-N-CA 124.362 1.065 . . . . 0.0 109.829 178.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.42 -53.61 54.07 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 119.402 1.001 . . . . 0.0 110.565 175.404 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 39.9 mt -53.22 -41.47 65.38 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 118.972 -0.537 . . . . 0.0 111.494 179.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 27.8 mmt -70.21 -65.14 0.76 Allowed 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 118.716 0.689 . . . . 0.0 109.643 175.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -43.71 -35.02 1.67 Allowed 'General case' 0 CA--C 1.518 -0.282 0 C-N-CA 128.356 2.662 . . . . 0.0 112.192 -174.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -37.85 -49.97 1.24 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.0 0.92 . . . . 0.0 111.87 173.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.9 pp -61.34 -43.48 98.79 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.366 0.53 . . . . 0.0 111.331 -177.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -69.6 -41.11 76.19 Favored 'General case' 0 C--O 1.226 -0.183 0 C-N-CA 123.941 0.896 . . . . 0.0 110.113 -177.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 14.2 ttm180 -62.73 -48.5 78.96 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 124.76 1.224 . . . . 0.0 110.033 179.55 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -77.64 -41.59 37.83 Favored 'General case' 0 C--O 1.226 -0.143 0 CA-C-N 116.713 -0.221 . . . . 0.0 111.248 -175.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 84.7 mttt 55.72 24.85 7.62 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.197 0.999 . . . . 0.0 111.735 -169.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 64.32 36.47 9.14 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.967 1.707 . . . . 0.0 112.221 -172.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -122.91 163.94 19.41 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 106.161 -1.792 . . . . 0.0 106.161 166.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 16.3 mp0 -75.51 144.68 41.86 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 123.171 0.589 . . . . 0.0 110.839 178.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 25.2 m -101.56 151.22 5.65 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 N-CA-C 106.698 -1.593 . . . . 0.0 106.698 167.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 10.2 p30 -94.67 171.86 8.53 Favored 'General case' 0 C--O 1.231 0.129 0 C-N-CA 123.404 0.682 . . . . 0.0 110.624 176.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -35.5 -59.87 0.53 Allowed 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.351 1.461 . . . . 0.0 113.486 177.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -66.53 -31.77 72.71 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 120.429 1.468 . . . . 0.0 111.616 -174.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -72.34 -36.44 68.81 Favored 'General case' 0 CA--C 1.534 0.351 0 O-C-N 121.271 -0.893 . . . . 0.0 109.822 177.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -56.29 -53.77 53.29 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 168.4 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 19.9 mm -53.74 -42.0 49.96 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.406 0 N-CA-C 109.473 -0.566 . . . . 0.0 109.473 177.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 70.4 m -63.06 -27.21 69.24 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 119.018 0.827 . . . . 0.0 111.831 177.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 10.7 t80 -58.35 -52.84 63.92 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 119.459 1.027 . . . . 0.0 108.321 170.131 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 48.8 mt -64.61 -41.31 96.29 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.861 0.865 . . . . 0.0 111.668 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -70.78 -42.27 61.77 Favored Glycine 0 CA--C 1.526 0.749 0 C-N-CA 124.408 1.004 . . . . 0.0 110.658 -175.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.21 -43.91 76.96 Favored 'General case' 0 N--CA 1.452 -0.333 0 O-C-N 121.924 -0.75 . . . . 0.0 110.079 175.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 12.1 tp -49.61 -56.8 8.71 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 121.281 0.563 . . . . 0.0 109.774 171.159 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . 0.479 ' HB1' HD11 ' A' ' 13' ' ' ILE . . . -50.15 -53.67 25.99 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 124.391 1.076 . . . . 0.0 110.32 178.188 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 53.7 ttm -54.45 -50.07 68.55 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.937 0.895 . . . . 0.0 111.129 -179.475 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 98.1 mt -63.95 -55.01 24.63 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.359 0 CA-C-O 118.48 -0.772 . . . . 0.0 110.578 -176.154 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.45 0.1 OUTLIER -76.69 -35.2 58.04 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 119.419 1.009 . . . . 0.0 113.284 -175.029 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 26.0 m-80 -82.55 72.79 9.61 Favored 'General case' 0 N--CA 1.465 0.284 0 O-C-N 120.63 -1.294 . . . . 0.0 107.97 169.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 20.8 mt-10 -46.89 -31.48 3.14 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.968 0.907 . . . . 0.0 113.051 -176.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -42.15 -41.88 2.81 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.879 1.272 . . . . 0.0 113.106 172.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 84.2 mt -68.25 -24.4 64.89 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.161 0.584 . . . . 0.0 112.424 -179.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 9.8 mtmp? -83.28 -51.98 6.97 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 172.119 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.218 0 CA-C-O 117.0 -2.0 . . . . 0.0 112.502 178.864 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.0 mtm . . . . . 0 N--CA 1.474 0.727 0 CA-C-O 120.481 0.181 . . . . 0.0 110.776 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -78.4 67.14 4.12 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 120.868 0.366 . . . . 0.0 110.523 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -57.59 165.84 2.07 Favored Pre-proline 0 CA--C 1.538 0.493 0 C-N-CA 124.282 1.033 . . . . 0.0 111.143 176.922 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_exo -46.26 -47.98 13.99 Favored 'Trans proline' 0 N--CA 1.457 -0.637 0 C-N-CA 123.367 2.711 . . . . 0.0 113.054 178.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.418 HD23 ' HA ' ' A' ' 5' ' ' LEU . 6.1 mt -56.95 -49.84 74.46 Favored 'General case' 0 C--N 1.34 0.168 0 CA-C-O 119.472 -0.299 . . . . 0.0 111.428 175.196 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -58.97 -45.04 91.52 Favored 'General case' 0 C--O 1.225 -0.185 0 CA-C-N 118.248 0.476 . . . . 0.0 109.857 -178.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 11.6 tp-100 -59.43 -49.99 75.67 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 122.9 0.48 . . . . 0.0 110.239 178.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.69 -45.87 84.8 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.416 0.687 . . . . 0.0 111.666 -177.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 71.5 mt -54.72 -50.94 56.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 171.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.74 -49.44 22.09 Favored Glycine 0 CA--C 1.526 0.771 0 C-N-CA 125.012 1.291 . . . . 0.0 111.527 174.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.3 mt -54.79 -56.67 16.89 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 117.576 0.688 . . . . 0.0 110.889 173.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -57.28 -42.59 81.93 Favored 'General case' 0 CA--C 1.539 0.551 0 CA-C-N 119.203 0.91 . . . . 0.0 111.72 -178.366 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 95.6 mt -59.81 -54.11 39.11 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.297 0 C-N-CA 123.518 0.727 . . . . 0.0 110.908 174.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.4 -50.59 61.63 Favored Glycine 0 CA--C 1.522 0.511 0 N-CA-C 109.883 -1.287 . . . . 0.0 109.883 -177.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 9.9 mm -50.87 -51.76 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.428 0 C-N-CA 123.92 0.888 . . . . 0.0 109.968 173.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -52.24 -61.57 2.19 Favored 'General case' 0 CA--C 1.53 0.206 0 N-CA-C 109.801 -0.444 . . . . 0.0 109.801 178.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 6.0 m-70 -65.33 -23.87 67.11 Favored 'General case' 0 N--CA 1.452 -0.336 0 N-CA-C 113.958 1.096 . . . . 0.0 113.958 -172.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 62.4 tttm -50.24 -31.94 15.35 Favored 'General case' 0 CA--C 1.538 0.518 0 CA-C-N 118.766 0.712 . . . . 0.0 111.147 169.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 82.8 m-85 -113.0 -33.54 6.01 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 123.482 0.713 . . . . 0.0 112.683 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 77.4 p -89.12 -32.08 17.68 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 119.891 1.223 . . . . 0.0 113.204 -178.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -79.96 50.82 3.98 Favored Glycine 0 C--N 1.334 0.471 0 C-N-CA 124.004 0.812 . . . . 0.0 112.232 -168.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 5.1 mmmm -115.99 -48.21 2.75 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 123.424 0.69 . . . . 0.0 111.795 -168.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -161.34 167.21 26.24 Favored 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 179.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 49.12 -124.48 13.33 Favored Glycine 0 CA--C 1.528 0.887 0 C-N-CA 124.775 1.179 . . . . 0.0 112.818 172.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -78.9 71.47 5.36 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.195 0.598 . . . . 0.0 109.39 -174.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 65.0 mttm -56.43 -15.86 4.84 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.18 0.992 . . . . 0.0 113.063 -179.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 9.7 t-80 -77.18 -4.33 44.06 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.627 0.771 . . . . 0.0 111.798 175.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 46.0 p -130.22 166.57 20.02 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 125.014 1.325 . . . . 0.0 111.452 -179.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -161.16 -177.19 5.9 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 125.377 1.471 . . . . 0.0 107.616 168.57 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.4 p -139.25 176.84 8.37 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 119.59 1.086 . . . . 0.0 112.805 -173.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 19.8 pttt -30.84 -53.78 0.19 Allowed 'General case' 0 N--CA 1.457 -0.099 0 C-N-CA 127.646 2.378 . . . . 0.0 114.874 179.057 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 24.8 ttpp -58.07 -49.12 78.03 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 118.888 0.767 . . . . 0.0 110.743 -179.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 10.4 mp0 -64.07 -36.02 82.63 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 122.685 0.394 . . . . 0.0 110.619 178.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 45.2 mt -68.07 -47.6 67.85 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.617 0.644 . . . . 0.0 111.204 179.117 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -56.44 -47.38 79.22 Favored 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 173.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -53.81 -58.08 8.54 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-O 119.167 -0.445 . . . . 0.0 110.975 172.77 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.0 mt -45.52 -61.18 1.79 Allowed 'General case' 0 N--CA 1.456 -0.16 0 C-N-CA 124.291 1.036 . . . . 0.0 110.406 -179.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 14.7 tt -61.06 -50.27 81.23 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.47 0 C-N-CA 120.507 -0.477 . . . . 0.0 109.858 -175.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -61.85 -53.18 59.39 Favored 'General case' 0 CA--C 1.537 0.451 0 O-C-N 121.493 -0.754 . . . . 0.0 112.305 -175.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -67.02 -59.03 3.82 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.988 0.915 . . . . 0.0 109.39 -178.315 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -79.78 -46.67 16.56 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-O 119.262 -0.399 . . . . 0.0 111.742 -168.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 20.1 mt -84.18 61.36 6.47 Favored 'General case' 0 C--O 1.232 0.145 0 CA-C-N 119.001 0.819 . . . . 0.0 109.41 174.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.3 t -73.58 69.25 1.24 Allowed 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 105.919 -1.882 . . . . 0.0 105.919 167.402 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 13.1 tt -78.73 -33.6 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 C-N-CA 125.359 1.464 . . . . 0.0 111.635 -168.342 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 134.51 -154.99 21.69 Favored Glycine 0 CA--C 1.522 0.496 0 N-CA-C 106.935 -2.466 . . . . 0.0 106.935 -170.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.5 p -75.95 67.53 2.33 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-N 117.725 0.762 . . . . 0.0 110.504 -179.264 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.404 ' HB3' HD11 ' A' ' 53' ' ' ILE . 34.0 mtmm 49.06 67.01 0.94 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.042 1.337 . . . . 0.0 111.29 173.671 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 11.7 mt -67.58 85.54 0.19 Allowed 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -169.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.6 tm0? 89.23 145.12 0.04 OUTLIER 'General case' 0 C--O 1.235 0.315 0 C-N-CA 127.936 2.494 . . . . 0.0 111.249 171.046 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -36.61 -43.98 0.43 Allowed 'General case' 0 C--O 1.225 -0.235 0 C-N-CA 128.002 2.521 . . . . 0.0 113.387 -169.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -30.33 -56.47 0.19 Allowed 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 125.793 1.637 . . . . 0.0 113.382 176.346 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.9 tm-20 -64.89 -41.52 95.55 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.64 0.734 . . . . 0.0 110.384 -173.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.544 HD12 ' H ' ' A' ' 53' ' ' ILE . 1.1 mp -66.28 -52.74 44.06 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 N-CA-C 107.053 -1.462 . . . . 0.0 107.053 -177.784 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 78.6 t -52.89 -41.06 38.72 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 C-N-CA 124.64 1.176 . . . . 0.0 109.777 175.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 1.7 mptp? -60.53 -51.88 67.54 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 118.988 0.813 . . . . 0.0 110.851 174.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 85.6 mt -52.08 -43.0 63.65 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 119.316 -0.373 . . . . 0.0 110.872 177.036 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 24.7 mmt -68.75 -62.42 1.39 Allowed 'General case' 0 CA--C 1.54 0.562 0 CA-C-N 118.475 0.579 . . . . 0.0 109.94 178.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -45.26 -40.61 7.71 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 127.093 2.157 . . . . 0.0 111.498 -177.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 36.6 t70 -40.94 -47.31 2.98 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 123.714 0.806 . . . . 0.0 112.462 175.029 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 8.1 mp -63.39 -53.86 45.87 Favored 'General case' 0 CA--C 1.531 0.212 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 -178.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -60.95 -34.11 74.23 Favored 'General case' 0 C--O 1.224 -0.283 0 C-N-CA 123.625 0.77 . . . . 0.0 111.279 -178.06 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.9 ttm180 -65.51 -55.68 16.52 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 173.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 5.4 m-80 -85.16 67.26 10.11 Favored 'General case' 0 C--O 1.234 0.239 0 C-N-CA 123.397 0.679 . . . . 0.0 109.915 -175.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 49.3 mttp -73.0 65.99 0.78 Allowed 'General case' 0 CA--C 1.536 0.437 0 N-CA-C 109.849 -0.426 . . . . 0.0 109.849 171.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 49.97 48.01 22.48 Favored 'General case' 0 CA--C 1.528 0.125 0 C-N-CA 125.321 1.448 . . . . 0.0 110.96 -173.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 26.3 mm-40 -138.76 152.03 47.6 Favored 'General case' 0 N--CA 1.451 -0.381 0 C-N-CA 125.59 1.556 . . . . 0.0 106.924 172.675 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -82.28 152.7 26.22 Favored 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 123.38 0.672 . . . . 0.0 109.593 171.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 11.3 m -103.07 144.31 14.01 Favored 'Isoleucine or valine' 0 C--O 1.234 0.283 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 170.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -86.29 168.4 13.93 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 122.835 0.454 . . . . 0.0 111.158 174.25 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -34.4 -61.31 0.39 Allowed 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 124.547 1.139 . . . . 0.0 112.718 172.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 48.5 tp60 -63.22 -31.66 72.86 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 119.791 1.178 . . . . 0.0 112.072 -174.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -69.68 -42.43 74.14 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 121.305 -0.872 . . . . 0.0 110.022 176.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -54.92 -51.38 66.26 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 109.597 -0.52 . . . . 0.0 109.597 170.769 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 26.9 mm -56.25 -40.26 64.66 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 C-N-CA 123.158 0.583 . . . . 0.0 110.117 176.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 86.2 m -64.6 -39.01 92.96 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 118.926 0.784 . . . . 0.0 110.961 176.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 44.9 t80 -54.95 -53.54 54.29 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 172.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 58.7 mt -59.14 -42.18 90.03 Favored 'General case' 0 CA--C 1.536 0.424 0 O-C-N 121.962 -0.461 . . . . 0.0 111.83 176.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -62.41 -45.86 95.05 Favored Glycine 0 CA--C 1.525 0.709 0 C-N-CA 124.177 0.894 . . . . 0.0 110.959 -178.436 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.89 -44.68 84.6 Favored 'General case' 0 N--CA 1.45 -0.458 0 O-C-N 122.182 -0.599 . . . . 0.0 110.061 177.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 13.1 tp -51.18 -57.24 9.28 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-O 121.325 0.583 . . . . 0.0 109.899 173.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -48.75 -56.17 9.38 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 114.812 -1.085 . . . . 0.0 109.942 177.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 46.7 ttm -52.33 -54.44 31.55 Favored 'General case' 0 N--CA 1.453 -0.313 0 C-N-CA 123.916 0.886 . . . . 0.0 111.071 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 42.1 mt -63.49 -45.75 96.98 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.323 0 CA-C-O 118.302 -0.856 . . . . 0.0 110.856 -171.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.446 0.1 OUTLIER -83.05 -30.93 27.66 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 114.169 1.174 . . . . 0.0 114.169 -179.844 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 24.3 m-80 -79.8 71.95 6.49 Favored 'General case' 0 C--O 1.236 0.355 0 O-C-N 120.926 -1.109 . . . . 0.0 108.433 170.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -65.0 74.18 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.572 1.549 . . . . 0.0 109.431 175.206 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -171.89 -47.38 0.02 OUTLIER 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 128.684 2.794 . . . . 0.0 106.851 -169.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 55.7 mt -58.58 -43.28 89.4 Favored 'General case' 0 C--N 1.343 0.306 0 N-CA-C 108.412 -0.958 . . . . 0.0 108.412 168.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -67.49 71.37 0.12 Allowed 'General case' 0 CA--C 1.535 0.381 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 168.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.221 0 CA-C-O 117.642 -1.644 . . . . 0.0 110.267 -169.922 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 3.7 mpp? . . . . . 0 N--CA 1.472 0.659 0 N-CA-C 110.396 -0.224 . . . . 0.0 110.396 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -74.09 75.92 1.74 Allowed 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 175.255 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -49.42 157.31 0.94 Allowed Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 125.459 1.504 . . . . 0.0 110.35 173.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -50.67 -48.42 20.65 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 122.911 2.407 . . . . 0.0 112.213 -174.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.7 mt -55.26 -52.82 62.17 Favored 'General case' 0 C--O 1.225 -0.231 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 172.146 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -58.68 -39.67 81.36 Favored 'General case' 0 C--O 1.225 -0.186 0 CA-C-N 118.243 0.474 . . . . 0.0 110.274 -175.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.4 tt0 -64.33 -50.99 65.62 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.503 1.121 . . . . 0.0 110.483 177.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.53 -45.44 94.15 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 121.443 0.639 . . . . 0.0 111.128 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 67.1 mt -53.19 -53.97 20.11 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 N-CA-C 108.258 -1.015 . . . . 0.0 108.258 169.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.6 -46.96 18.08 Favored Glycine 0 CA--C 1.526 0.775 0 C-N-CA 125.368 1.461 . . . . 0.0 111.986 176.249 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.7 mt -55.45 -56.07 24.4 Favored 'General case' 0 CA--C 1.535 0.402 0 CA-C-N 117.635 0.717 . . . . 0.0 110.742 173.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.4 mp -57.59 -42.94 84.21 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 118.973 0.806 . . . . 0.0 111.6 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 77.8 mt -56.97 -55.55 19.67 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 C-N-CA 123.336 0.654 . . . . 0.0 110.173 174.096 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.24 -49.68 62.69 Favored Glycine 0 CA--C 1.522 0.527 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 -177.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.5 mm -52.36 -48.71 44.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 C-N-CA 123.242 0.617 . . . . 0.0 110.137 174.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 57.9 t80 -56.51 -58.2 9.05 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 118.491 0.587 . . . . 0.0 110.47 176.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -54.61 -36.96 65.03 Favored 'General case' 0 N--CA 1.453 -0.292 0 C-N-CA 125.002 1.321 . . . . 0.0 111.208 -174.594 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -49.7 -34.43 18.7 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.062 0.945 . . . . 0.0 111.957 177.215 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 81.4 m-85 -106.62 -47.67 3.71 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.325 0.65 . . . . 0.0 110.837 178.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 22.7 t -63.64 -24.7 67.9 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.839 0.856 . . . . 0.0 112.422 -177.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -72.7 45.13 1.03 Allowed Glycine 0 CA--C 1.529 0.915 0 C-N-CA 124.267 0.936 . . . . 0.0 114.613 -172.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 25.0 mttm -142.18 -43.47 0.33 Allowed 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 118.554 1.177 . . . . 0.0 111.246 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -75.29 47.5 0.38 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 124.911 1.284 . . . . 0.0 114.369 -168.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 69.11 -74.68 0.36 Allowed Glycine 0 CA--C 1.529 0.922 0 C-N-CA 123.957 0.789 . . . . 0.0 112.155 174.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -89.92 105.45 17.81 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 172.138 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 30.0 mmtm -80.26 48.02 0.97 Allowed 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.568 0.747 . . . . 0.0 111.068 -171.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 45.6 t-80 -122.85 -10.47 8.24 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 125.691 1.597 . . . . 0.0 111.429 -174.167 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 41.3 p -135.04 163.05 30.75 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.899 1.28 . . . . 0.0 110.459 -175.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -159.87 164.95 33.14 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.527 0.731 . . . . 0.0 110.988 169.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 93.6 p -97.97 168.0 10.56 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.462 1.105 . . . . 0.0 113.641 -169.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 13.6 pttm -40.04 -53.19 2.43 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 126.781 2.032 . . . . 0.0 112.617 171.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -54.65 -45.45 73.82 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 123.39 0.676 . . . . 0.0 109.968 178.771 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -71.36 -35.79 71.24 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 123.485 0.714 . . . . 0.0 111.073 -176.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 13.3 mt -62.91 -49.35 75.13 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.224 0.92 . . . . 0.0 110.896 170.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -58.03 -46.31 85.52 Favored 'General case' 0 CA--C 1.534 0.336 0 N-CA-C 109.961 -0.385 . . . . 0.0 109.961 178.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -54.08 -57.17 12.09 Favored 'General case' 0 C--O 1.222 -0.344 0 CA-C-O 119.001 -0.524 . . . . 0.0 110.663 171.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 9.3 mt -45.44 -60.73 2.0 Favored 'General case' 0 N--CA 1.457 -0.09 0 C-N-CA 123.625 0.77 . . . . 0.0 110.48 -178.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 19.8 tt -60.1 -52.98 54.87 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.464 0 C-N-CA 120.287 -0.565 . . . . 0.0 110.118 -177.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -59.47 -49.88 76.07 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 121.739 -0.601 . . . . 0.0 112.535 -174.528 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -73.11 -53.79 10.14 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.696 0.798 . . . . 0.0 109.815 -176.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 51.8 mm-40 -81.68 -26.62 34.55 Favored 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 113.352 0.871 . . . . 0.0 113.352 -167.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 23.9 mt -102.14 89.98 3.79 Favored 'General case' 0 CA--C 1.523 -0.083 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 169.243 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 63.0 p -76.44 61.43 1.72 Allowed 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 124.624 1.17 . . . . 0.0 108.783 179.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 15.2 mt -80.36 -60.29 2.34 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.552 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 177.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 69.2 -73.1 0.41 Allowed Glycine 0 CA--C 1.528 0.844 0 N-CA-C 110.425 -1.07 . . . . 0.0 110.425 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 15.6 m -61.31 99.93 0.12 Allowed 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 124.6 1.16 . . . . 0.0 108.467 169.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 25.0 mmtm -59.91 80.58 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 125.969 1.708 . . . . 0.0 111.93 -171.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . 0.258 4.3 pp -57.67 -35.67 70.87 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -169.014 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -164.05 153.51 14.18 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 119.254 0.933 . . . . 0.0 108.733 179.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -41.92 -40.05 2.03 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 128.137 2.575 . . . . 0.0 114.162 -171.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -35.7 -56.1 0.69 Allowed 'General case' 0 C--O 1.226 -0.14 0 C-N-CA 125.356 1.462 . . . . 0.0 113.148 -175.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -61.69 -41.83 98.11 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 123.444 0.697 . . . . 0.0 111.18 -176.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 53' ' ' ILE . . . . . 0.505 ' H ' ' CD1' ' B' ' 53' ' ' ILE . 1.1 mp -63.75 -54.08 36.56 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 106.852 -1.536 . . . . 0.0 106.852 -178.289 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 82.5 t -56.84 -41.13 75.22 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 CA-C-N 115.265 -0.88 . . . . 0.0 109.729 179.157 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.44 -51.81 68.3 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 118.907 0.776 . . . . 0.0 110.073 177.507 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 44.9 mt -53.87 -41.11 67.16 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 119.361 -0.352 . . . . 0.0 111.404 179.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.05 -61.68 1.68 Allowed 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 118.642 0.656 . . . . 0.0 109.753 175.324 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -44.37 -36.4 2.82 Favored 'General case' 0 C--O 1.225 -0.205 0 C-N-CA 126.644 1.978 . . . . 0.0 111.949 -177.206 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -37.38 -46.88 0.81 Allowed 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 125.661 1.584 . . . . 0.0 112.717 178.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -59.27 -49.71 76.8 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 120.665 0.269 . . . . 0.0 110.394 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -64.42 -42.96 95.76 Favored 'General case' 0 C--O 1.225 -0.216 0 C-N-CA 124.089 0.956 . . . . 0.0 110.1 179.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.69 -45.33 70.33 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 125.697 1.599 . . . . 0.0 109.4 176.64 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 3.7 m-80 -73.12 -44.27 60.52 Favored 'General case' 0 C--O 1.227 -0.091 0 C-N-CA 122.94 0.496 . . . . 0.0 112.136 178.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 86.0 mttt 58.33 33.2 22.92 Favored 'General case' 0 CA--C 1.538 0.514 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 -166.372 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 54.04 18.8 1.82 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 126.445 1.898 . . . . 0.0 114.53 -169.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 54.1 mm-40 -106.35 158.67 16.71 Favored 'General case' 0 N--CA 1.452 -0.362 0 N-CA-C 106.673 -1.602 . . . . 0.0 106.673 167.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 23.7 mt-10 -66.1 142.12 57.89 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 120.639 -0.424 . . . . 0.0 110.127 172.645 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 14.5 m -86.57 150.78 3.74 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 171.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 5.2 p30 -91.35 172.78 8.29 Favored 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 123.293 0.637 . . . . 0.0 111.86 176.327 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 51.3 t80 -41.42 -62.13 0.92 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.258 1.023 . . . . 0.0 113.591 177.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 10.0 tp-100 -65.4 -31.35 72.41 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-N 120.094 1.316 . . . . 0.0 110.808 -177.085 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -64.14 -41.3 97.24 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 119.175 0.898 . . . . 0.0 110.569 175.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -57.78 -49.76 75.52 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 121.462 -0.774 . . . . 0.0 110.023 169.658 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 21.5 mm -60.07 -26.7 36.96 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 O-C-N 121.787 -0.571 . . . . 0.0 110.782 176.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 52.8 m -75.05 -37.5 61.67 Favored 'General case' 0 C--O 1.225 -0.225 0 O-C-N 120.95 -1.094 . . . . 0.0 110.345 173.072 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 29.1 t80 -55.29 -55.06 35.79 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 118.914 0.779 . . . . 0.0 109.235 170.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 43.9 mt -61.22 -47.3 86.76 Favored 'General case' 0 CA--C 1.531 0.233 0 O-C-N 122.085 -0.385 . . . . 0.0 111.694 177.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -62.1 -41.89 99.71 Favored Glycine 0 CA--C 1.526 0.735 0 N-CA-C 110.946 -0.862 . . . . 0.0 110.946 -175.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -67.18 -46.5 73.74 Favored 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 123.498 0.719 . . . . 0.0 110.268 175.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 18.1 tp -49.97 -53.55 25.73 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 174.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -53.48 -56.83 13.68 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 124.065 0.946 . . . . 0.0 110.394 175.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 40.3 ttm -47.94 -46.62 32.36 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 123.79 0.836 . . . . 0.0 111.052 -179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 30.8 mt -72.89 -51.92 24.85 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 CA-C-O 117.908 -1.044 . . . . 0.0 111.379 -176.149 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.416 0.0 OUTLIER -85.11 -36.46 21.13 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 120.31 1.414 . . . . 0.0 114.711 -175.198 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 32.8 m120 -81.87 62.44 5.66 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 107.259 -1.385 . . . . 0.0 107.259 171.036 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 67.2 mt-10 -44.97 -36.49 3.42 Favored 'General case' 0 C--N 1.339 0.111 0 C-N-CA 126.104 1.762 . . . . 0.0 113.618 -169.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -47.77 -31.93 5.41 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 124.384 1.074 . . . . 0.0 113.015 178.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 31.6 mt -50.16 -39.89 45.01 Favored 'General case' 0 C--N 1.34 0.177 0 C-N-CA 122.761 0.424 . . . . 0.0 111.949 174.272 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 8.6 mtmp? -77.83 51.89 0.98 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.7 0.8 . . . . 0.0 111.959 -172.049 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.11 0 CA-C-O 117.57 -1.683 . . . . 0.0 110.34 177.768 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.7 ptm . . . . . 0 N--CA 1.476 0.852 0 CA-C-O 121.966 0.888 . . . . 0.0 110.584 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -72.18 82.72 1.0 Allowed 'General case' 0 N--CA 1.453 -0.315 0 CA-C-N 115.582 -0.736 . . . . 0.0 111.178 -173.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.4 m -49.25 158.59 0.72 Allowed Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 124.202 1.001 . . . . 0.0 111.433 170.025 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -47.54 -48.28 15.89 Favored 'Trans proline' 0 N--CA 1.459 -0.539 0 C-N-CA 123.354 2.703 . . . . 0.0 113.402 -177.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.0 mt -57.42 -49.24 76.87 Favored 'General case' 0 C--O 1.226 -0.183 0 C-N-CA 120.618 -0.433 . . . . 0.0 112.094 173.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -60.97 -41.57 96.63 Favored 'General case' 0 N--CA 1.454 -0.25 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 -175.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 19.8 tt0 -59.77 -51.63 68.93 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.801 0.84 . . . . 0.0 110.677 175.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.35 -45.67 92.15 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.506 0.669 . . . . 0.0 111.271 -177.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 66.1 mt -53.28 -51.75 37.43 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 169.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.17 -48.2 20.35 Favored Glycine 0 CA--C 1.528 0.86 0 C-N-CA 125.183 1.373 . . . . 0.0 111.835 174.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.3 mt -55.12 -55.25 33.18 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 117.83 0.815 . . . . 0.0 110.795 174.067 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.0 mp -58.2 -41.71 84.6 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.55 0.614 . . . . 0.0 111.715 -179.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 97.1 mt -60.58 -51.33 74.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 C-N-CA 123.494 0.718 . . . . 0.0 110.733 174.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.99 -54.03 36.37 Favored Glycine 0 CA--C 1.521 0.462 0 N-CA-C 109.198 -1.561 . . . . 0.0 109.198 -179.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 7.2 mm -51.51 -50.77 28.3 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.296 0 C-N-CA 124.102 0.961 . . . . 0.0 110.375 175.145 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -50.63 -60.51 2.96 Favored 'General case' 0 C--N 1.339 0.121 0 N-CA-C 109.896 -0.409 . . . . 0.0 109.896 177.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -59.33 -39.39 82.97 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 121.041 -0.263 . . . . 0.0 111.088 -175.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.7 ttpp -53.64 -24.77 15.23 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.096 0.958 . . . . 0.0 111.85 178.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 79.3 m-85 -133.9 42.2 2.95 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 118.461 0.573 . . . . 0.0 110.774 169.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 63.6 p -83.05 -87.62 0.1 Allowed 'General case' 0 N--CA 1.457 -0.114 0 CA-C-O 122.254 1.026 . . . . 0.0 108.487 174.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -163.18 71.36 0.2 Allowed Glycine 0 N--CA 1.442 -0.917 0 N-CA-C 106.303 -2.719 . . . . 0.0 106.303 175.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 46.7 mtmt -55.82 120.51 7.47 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 108.097 -1.075 . . . . 0.0 108.097 178.134 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 58.76 33.32 22.98 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.532 1.133 . . . . 0.0 112.614 -173.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -162.0 -103.84 0.18 Allowed Glycine 0 CA--C 1.528 0.875 0 N-CA-C 110.142 -1.183 . . . . 0.0 110.142 173.17 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -79.38 62.79 3.82 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.845 -0.797 . . . . 0.0 111.176 -176.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.5 mptm? -39.65 -43.72 1.4 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 125.254 1.422 . . . . 0.0 114.1 -171.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 26.1 m80 -120.15 20.38 12.06 Favored 'General case' 0 CA--C 1.533 0.324 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 -169.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 6.0 p -140.46 173.07 11.86 Favored 'General case' 0 CA--C 1.529 0.164 0 N-CA-C 108.558 -0.904 . . . . 0.0 108.558 173.281 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 4.2 pp -160.25 -176.31 5.56 Favored 'General case' 0 C--N 1.337 0.024 0 C-N-CA 123.873 0.869 . . . . 0.0 109.533 176.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 87.4 p -152.7 -175.52 5.34 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 119.073 0.851 . . . . 0.0 111.955 -178.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 53.7 mtpt -19.7 -69.56 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 129.381 3.072 . . . . 0.0 113.51 175.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -51.53 -50.63 59.64 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 124.874 1.269 . . . . 0.0 110.568 -177.394 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 14.1 mp0 -64.65 -42.77 95.21 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-O 119.157 -0.449 . . . . 0.0 109.87 -177.485 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 71.9 mt -60.99 -50.1 74.76 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 118.881 0.764 . . . . 0.0 111.21 177.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -59.56 -44.96 93.12 Favored 'General case' 0 CA--C 1.534 0.36 0 O-C-N 121.937 -0.477 . . . . 0.0 110.298 179.117 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 72.0 mt-10 -56.42 -52.36 64.93 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 122.57 0.348 . . . . 0.0 111.197 173.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 16.3 mt -49.51 -54.82 15.83 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 123.726 0.81 . . . . 0.0 109.471 179.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 40.7 mm -54.45 -65.87 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 175.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 18.5 tt0 -57.0 -49.24 76.39 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.7 0.63 . . . . 0.0 112.7 -169.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.7 -53.76 8.03 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.2 0.6 . . . . 0.0 110.426 -177.291 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 52.4 mm-40 -85.22 -16.59 39.73 Favored 'General case' 0 C--N 1.339 0.14 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -168.143 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 94.1 mt -114.34 89.04 2.99 Favored 'General case' 0 N--CA 1.458 -0.073 0 N-CA-C 107.365 -1.346 . . . . 0.0 107.365 168.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 73.3 p -77.77 55.76 1.42 Allowed 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 124.628 1.171 . . . . 0.0 109.366 -178.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 63.8 mt -87.21 -56.3 5.45 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.465 0 N-CA-C 106.732 -1.581 . . . . 0.0 106.732 177.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 71.26 -70.85 0.81 Allowed Glycine 0 CA--C 1.527 0.799 0 N-CA-C 110.618 -0.993 . . . . 0.0 110.618 179.061 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 56.1 m -71.24 76.0 0.72 Allowed 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 169.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 5.0 mttp -44.48 95.83 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 125.844 1.658 . . . . 0.0 112.385 -176.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 1.5 pp -59.58 -10.56 3.6 Favored 'General case' 0 CA--C 1.538 0.513 0 N-CA-C 115.909 1.818 . . . . 0.0 115.909 -169.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.2 tt0 -161.19 164.82 30.22 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-N 119.718 1.145 . . . . 0.0 108.177 169.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 14.4 p-10 -38.56 -42.82 0.8 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 127.246 2.218 . . . . 0.0 113.578 176.289 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.88 -60.85 0.16 Allowed 'General case' 0 N--CA 1.46 0.038 0 C-N-CA 126.22 1.808 . . . . 0.0 113.3 -177.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -67.64 -38.71 84.25 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 116.467 -0.333 . . . . 0.0 110.836 -171.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.592 HD12 ' H ' ' A' ' 53' ' ' ILE . 1.6 mp -61.89 -53.38 48.86 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 N-CA-C 106.164 -1.791 . . . . 0.0 106.164 179.131 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 85.0 t -57.83 -44.46 86.26 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.454 0 C-N-CA 124.073 0.949 . . . . 0.0 110.552 -177.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -58.67 -50.61 73.23 Favored 'General case' 0 CA--C 1.528 0.116 0 CA-C-N 119.262 0.937 . . . . 0.0 111.202 173.263 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 63.2 mt -56.43 -38.22 71.29 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-O 119.115 -0.469 . . . . 0.0 111.446 178.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 23.3 mmt -69.38 -61.76 1.66 Allowed 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.117 0.871 . . . . 0.0 109.683 175.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -45.88 -40.47 10.04 Favored 'General case' 0 CA--C 1.52 -0.196 0 C-N-CA 126.96 2.104 . . . . 0.0 111.467 -175.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -38.29 -49.97 1.43 Allowed 'General case' 0 N--CA 1.455 -0.212 0 C-N-CA 124.964 1.305 . . . . 0.0 111.546 174.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 77.0 mt -56.69 -50.96 70.59 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 122.495 0.318 . . . . 0.0 110.186 -175.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -69.41 -44.9 70.46 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 123.268 0.627 . . . . 0.0 110.911 -179.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 16.9 ttm180 -55.65 -47.17 77.11 Favored 'General case' 0 N--CA 1.454 -0.256 0 C-N-CA 124.128 0.971 . . . . 0.0 110.16 -179.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 4.5 m-80 -72.3 -56.29 5.74 Favored 'General case' 0 N--CA 1.455 -0.198 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 178.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 15.0 ttmm 52.69 39.01 27.67 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 121.63 0.729 . . . . 0.0 109.137 -168.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 53.5 m-20 66.47 0.02 1.65 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 126.922 2.089 . . . . 0.0 114.617 -174.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 27.5 mm100 -82.93 155.65 23.94 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 119.176 0.898 . . . . 0.0 108.636 168.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -73.14 161.16 30.92 Favored 'General case' 0 N--CA 1.454 -0.247 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.987 173.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.7 m -117.57 160.24 17.24 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.378 0 C-N-CA 126.063 1.745 . . . . 0.0 107.955 168.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -105.98 -175.02 2.68 Favored 'General case' 0 CA--C 1.528 0.121 0 C-N-CA 125.102 1.361 . . . . 0.0 111.741 178.32 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -47.86 -66.14 0.45 Allowed 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 124.328 1.051 . . . . 0.0 112.001 176.069 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.1 tp60 -60.76 -35.56 76.73 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 119.565 1.075 . . . . 0.0 111.453 -173.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -61.61 -47.18 86.61 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 121.548 -0.72 . . . . 0.0 110.983 175.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -54.74 -50.6 67.99 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.993 -0.442 . . . . 0.0 109.954 172.549 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.405 ' CG2' ' CG2' ' B' ' 74' ' ' ILE . 25.3 mm -57.16 -37.45 55.89 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 C-N-CA 122.97 0.508 . . . . 0.0 110.331 177.533 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 86.6 m -68.09 -39.3 82.91 Favored 'General case' 0 N--CA 1.456 -0.143 0 O-C-N 121.513 -0.742 . . . . 0.0 110.315 177.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 38.0 t80 -56.57 -54.99 39.51 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 173.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 49.2 mt -59.92 -40.0 87.39 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 120.726 0.298 . . . . 0.0 111.476 176.067 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -60.08 -49.64 76.32 Favored Glycine 0 CA--C 1.524 0.607 0 N-CA-C 110.365 -1.094 . . . . 0.0 110.365 -179.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.9 -44.96 91.4 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 123.178 0.591 . . . . 0.0 110.25 178.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 11.0 tp -50.52 -57.91 7.0 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.636 0.731 . . . . 0.0 109.734 174.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.45 -53.58 43.66 Favored 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 125.037 1.335 . . . . 0.0 110.303 179.558 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 39.4 ttm -52.06 -50.06 62.25 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 125.542 1.537 . . . . 0.0 111.026 179.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 93.3 mt -69.0 -54.9 17.63 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 CA-C-O 118.698 -0.668 . . . . 0.0 110.294 -174.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.451 0.1 OUTLIER -76.14 -35.46 59.21 Favored 'General case' 0 C--N 1.344 0.351 0 C-N-CA 119.051 -1.06 . . . . 0.0 113.398 -173.599 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.4 m-80 -85.13 63.29 8.02 Favored 'General case' 0 N--CA 1.463 0.196 0 N-CA-C 106.593 -1.632 . . . . 0.0 106.593 168.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -43.92 -36.77 2.55 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.541 1.136 . . . . 0.0 112.505 -175.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.38 -47.46 0.21 Allowed 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 127.015 2.126 . . . . 0.0 113.165 169.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 20.3 mt -45.44 -45.87 13.19 Favored 'General case' 0 C--O 1.225 -0.206 0 C-N-CA 123.974 0.91 . . . . 0.0 111.322 178.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 65.5 mttm -64.94 1.11 0.98 Allowed 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 -175.51 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.313 0 CA-C-O 116.227 -2.429 . . . . 0.0 115.245 179.241 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 12.1 tpt . . . . . 0 N--CA 1.474 0.743 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -76.64 76.2 3.31 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 121.412 0.625 . . . . 0.0 109.488 175.064 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -50.41 159.66 0.83 Allowed Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 124.999 1.319 . . . . 0.0 110.841 170.391 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -52.22 -49.35 17.68 Favored 'Trans proline' 0 N--CA 1.459 -0.538 0 C-N-CA 122.599 2.199 . . . . 0.0 112.1 -178.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.7 mt -58.09 -45.68 86.76 Favored 'General case' 0 C--O 1.226 -0.182 0 C-N-CA 120.624 -0.431 . . . . 0.0 111.03 174.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 23.7 t70 -58.07 -47.36 83.39 Favored 'General case' 0 N--CA 1.456 -0.137 0 CA-C-N 118.164 0.438 . . . . 0.0 109.835 -177.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 tp60 -60.61 -47.81 84.56 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 122.913 0.485 . . . . 0.0 110.896 177.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.66 -45.74 81.8 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-O 121.209 0.528 . . . . 0.0 111.46 -176.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 74.2 mt -54.14 -51.51 46.31 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 170.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.16 -47.46 20.85 Favored Glycine 0 CA--C 1.528 0.869 0 C-N-CA 124.797 1.189 . . . . 0.0 111.889 174.9 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 mt -56.26 -57.31 12.79 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 117.582 0.691 . . . . 0.0 110.635 174.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.6 mp -57.9 -41.18 82.08 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.047 0.84 . . . . 0.0 111.805 -177.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 74.0 mt -58.22 -56.41 16.27 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 C-N-CA 124.02 0.928 . . . . 0.0 110.741 172.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.64 -50.73 59.17 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 109.942 -1.263 . . . . 0.0 109.942 -176.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.8 mm -51.15 -50.58 25.28 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.421 0 C-N-CA 124.076 0.95 . . . . 0.0 110.107 173.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -54.05 -57.71 10.03 Favored 'General case' 0 N--CA 1.455 -0.176 0 CA-C-N 118.107 0.412 . . . . 0.0 110.222 179.088 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 41.9 m-70 -63.43 -29.23 70.55 Favored 'General case' 0 N--CA 1.454 -0.248 0 N-CA-C 112.753 0.649 . . . . 0.0 112.753 -176.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 64.5 tttp -50.45 -33.21 20.21 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 119.061 0.846 . . . . 0.0 111.841 176.096 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 88.5 m-85 -108.62 -44.37 4.07 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.395 0.678 . . . . 0.0 111.083 177.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.2 m -75.26 -32.86 61.2 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.927 0.891 . . . . 0.0 112.751 -174.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.25 61.43 3.49 Favored Glycine 0 CA--C 1.523 0.591 0 C-N-CA 124.23 0.919 . . . . 0.0 111.944 -169.438 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 90.1 mttt -136.34 -157.59 0.8 Allowed 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 124.524 1.13 . . . . 0.0 109.361 -176.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -76.58 70.61 3.13 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.858 0.863 . . . . 0.0 111.264 -170.04 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -173.61 -161.75 24.33 Favored Glycine 0 CA--C 1.526 0.723 0 N-CA-C 109.239 -1.544 . . . . 0.0 109.239 176.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -77.81 94.53 4.52 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 177.076 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 36.2 mtmm -59.94 -14.19 14.59 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.032 1.333 . . . . 0.0 113.411 -170.188 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -77.14 -4.75 46.1 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.37 1.068 . . . . 0.0 111.829 174.006 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 20.2 p -137.93 164.69 28.39 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.442 1.097 . . . . 0.0 111.304 -172.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.5 175.67 12.48 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.801 1.24 . . . . 0.0 109.184 169.507 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.2 t -131.39 -163.17 1.29 Allowed 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 124.499 1.12 . . . . 0.0 112.55 -176.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 6.4 mtpm? -39.71 -67.51 0.22 Allowed 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 128.515 2.726 . . . . 0.0 113.461 -169.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -60.94 -46.85 89.03 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 -169.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -54.35 -44.67 72.35 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.48 0.712 . . . . 0.0 110.747 177.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 30.5 mt -65.06 -47.06 78.65 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-N 118.065 0.393 . . . . 0.0 111.599 178.543 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 58.5 mttp -57.08 -46.48 82.5 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 120.465 -0.494 . . . . 0.0 110.647 175.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -57.66 -49.36 76.74 Favored 'General case' 0 C--O 1.22 -0.463 0 C-N-CA 122.955 0.502 . . . . 0.0 110.397 175.684 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 10.4 mt -48.16 -53.47 16.68 Favored 'General case' 0 CA--C 1.527 0.09 0 CA-C-N 119.15 0.886 . . . . 0.0 110.25 178.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 39.8 mt -57.84 -62.09 1.08 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 C-N-CA 120.45 -0.5 . . . . 0.0 110.297 175.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 22.2 tt0 -50.04 -46.87 53.44 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.484 0.714 . . . . 0.0 112.534 -172.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 9.1 mmpt? -81.43 -52.33 7.38 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 125.342 1.457 . . . . 0.0 110.451 -172.198 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 50.2 mm-40 -95.75 -16.83 21.68 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 113.594 0.961 . . . . 0.0 113.594 -168.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 54.3 mt -120.42 79.3 1.46 Allowed 'General case' 0 C--N 1.335 -0.033 0 C-N-CA 125.309 1.444 . . . . 0.0 108.154 173.712 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 59.4 p -79.11 47.9 0.82 Allowed 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.108 0.963 . . . . 0.0 109.72 -177.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 20.5 mt -83.71 79.99 1.52 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 -174.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -52.95 -47.03 60.37 Favored Glycine 0 CA--C 1.529 0.939 0 N-CA-C 109.967 -1.253 . . . . 0.0 109.967 171.661 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 7.0 m -72.26 65.72 0.62 Allowed 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.398 1.079 . . . . 0.0 110.295 172.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . 0.655 ' HB3' HD11 ' B' ' 53' ' ' ILE . 62.8 mmtt -48.23 92.41 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 126.611 1.964 . . . . 0.0 112.293 -173.002 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 77.0 mt -60.47 120.28 9.63 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.358 1.063 . . . . 0.0 113.442 -169.805 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 65.98 -70.88 0.09 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 127.108 2.163 . . . . 0.0 113.708 168.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 18.0 p-10 179.38 -39.72 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 126.584 1.953 . . . . 0.0 109.148 -169.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.42 -61.33 0.14 Allowed 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 126.895 2.078 . . . . 0.0 113.831 -177.135 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -67.18 -38.71 85.86 Favored 'General case' 0 N--CA 1.455 -0.179 0 CA-C-O 120.804 0.335 . . . . 0.0 111.282 -172.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 53' ' ' ILE . . . . . 0.677 HD12 ' H ' ' B' ' 53' ' ' ILE . 2.1 mp -63.18 -53.89 40.31 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.477 0 N-CA-C 106.861 -1.533 . . . . 0.0 106.861 179.057 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 79.6 t -55.31 -45.35 77.79 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.408 0 C-N-CA 124.309 1.044 . . . . 0.0 110.134 179.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -58.17 -52.45 65.52 Favored 'General case' 0 CA--C 1.529 0.143 0 CA-C-N 118.97 0.805 . . . . 0.0 110.203 176.364 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 62.9 mt -54.79 -39.5 68.51 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 119.43 -0.319 . . . . 0.0 111.418 -179.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.83 -67.35 0.48 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 118.484 0.583 . . . . 0.0 109.524 173.727 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -39.62 -41.2 1.01 Allowed 'General case' 0 N--CA 1.464 0.23 0 C-N-CA 127.364 2.266 . . . . 0.0 112.092 -176.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 24.2 t70 -37.88 -49.89 1.24 Allowed 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.162 1.385 . . . . 0.0 112.158 176.039 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -65.75 -33.7 76.47 Favored 'General case' 0 N--CA 1.456 -0.152 0 N-CA-C 111.699 0.259 . . . . 0.0 111.699 -174.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -76.8 -53.1 8.37 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 108.613 -0.884 . . . . 0.0 108.613 177.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 14.3 ttm180 -48.0 -41.57 25.7 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.311 1.044 . . . . 0.0 110.686 177.276 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 7.8 m-80 -111.93 49.49 0.9 Allowed 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 123.911 0.884 . . . . 0.0 109.916 -178.298 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -72.36 65.57 0.63 Allowed 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.703 0.683 . . . . 0.0 111.184 176.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 69.17 47.98 0.7 Allowed 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 127.08 2.152 . . . . 0.0 110.284 -169.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 6.4 mp0 -128.58 155.93 44.15 Favored 'General case' 0 C--O 1.233 0.206 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 169.515 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 64.8 mm-40 -105.2 113.87 27.73 Favored 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 106.042 -1.836 . . . . 0.0 106.042 169.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 12.3 m -79.25 142.28 14.22 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 176.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -82.41 170.31 15.44 Favored 'General case' 0 N--CA 1.461 0.108 0 C-N-CA 122.917 0.487 . . . . 0.0 111.578 177.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -35.37 -63.02 0.37 Allowed 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.051 1.34 . . . . 0.0 112.82 173.177 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 10.1 tp-100 -64.53 -32.37 73.98 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 120.35 1.432 . . . . 0.0 111.817 -175.699 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -66.29 -39.38 89.32 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 120.966 -1.084 . . . . 0.0 110.274 176.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.03 -48.59 79.61 Favored 'General case' 0 CA--C 1.536 0.437 0 O-C-N 121.713 -0.617 . . . . 0.0 109.622 169.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 0.405 ' CG2' ' CG2' ' A' ' 74' ' ' ILE . 20.0 mm -62.18 -23.89 33.16 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 O-C-N 121.612 -0.68 . . . . 0.0 110.891 175.638 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 39.7 m -77.88 -33.72 51.89 Favored 'General case' 0 C--O 1.224 -0.273 0 O-C-N 120.762 -1.211 . . . . 0.0 110.426 171.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -60.16 -55.77 29.72 Favored 'General case' 0 CA--C 1.536 0.441 0 O-C-N 121.298 -0.876 . . . . 0.0 108.977 170.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 45.4 mt -62.8 -41.62 99.36 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-O 121.035 0.445 . . . . 0.0 111.773 177.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.9 -43.27 96.27 Favored Glycine 0 CA--C 1.525 0.703 0 N-CA-C 110.598 -1.001 . . . . 0.0 110.598 -178.231 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.55 -46.29 86.64 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 123.349 0.66 . . . . 0.0 110.209 174.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 6.8 tp -50.41 -58.14 6.39 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.403 0.621 . . . . 0.0 109.83 174.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.5 -52.81 35.1 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.86 1.264 . . . . 0.0 110.21 178.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 57.1 ttm -57.14 -47.43 81.17 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 124.19 0.996 . . . . 0.0 111.139 -178.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 97.1 mt -65.42 -58.63 6.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.481 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 -176.765 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.448 1.1 p90 -67.09 -40.58 86.99 Favored 'General case' 0 C--N 1.344 0.348 0 C-N-CA 118.218 -1.393 . . . . 0.0 112.501 -174.489 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 28.3 m-80 -81.71 66.98 7.51 Favored 'General case' 0 N--CA 1.463 0.181 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 169.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -44.0 -35.44 2.07 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.842 1.257 . . . . 0.0 113.815 -171.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -32.84 -53.3 0.34 Allowed 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 125.537 1.535 . . . . 0.0 112.246 168.787 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 69.1 mt -72.37 0.83 9.07 Favored 'General case' 0 CA--C 1.534 0.351 0 N-CA-C 113.787 1.032 . . . . 0.0 113.787 -171.648 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -68.49 73.31 0.23 Allowed 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 120.108 1.322 . . . . 0.0 109.866 174.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.375 0 CA-C-O 117.934 -1.481 . . . . 0.0 110.678 -177.664 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.0 ptm . . . . . 0 N--CA 1.475 0.822 0 N-CA-C 111.08 0.03 . . . . 0.0 111.08 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -130.24 112.55 13.46 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 173.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 40.0 p -73.68 170.58 13.68 Favored Pre-proline 0 N--CA 1.451 -0.38 0 C-N-CA 123.206 0.602 . . . . 0.0 110.059 175.299 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -50.58 -43.93 42.77 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.299 1.999 . . . . 0.0 110.658 168.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.448 HD23 ' HA ' ' A' ' 5' ' ' LEU . 4.8 mt -53.38 -61.06 2.54 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-O 119.234 -0.412 . . . . 0.0 111.531 170.204 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -56.9 -39.22 74.01 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 118.495 0.589 . . . . 0.0 111.172 -174.237 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 -61.19 -51.04 70.67 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.782 0.833 . . . . 0.0 110.686 175.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.22 -44.9 95.52 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.454 0.702 . . . . 0.0 111.323 -178.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 95.4 mt -54.87 -52.26 44.68 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.356 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 171.08 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.3 -47.43 21.71 Favored Glycine 0 CA--C 1.526 0.759 0 C-N-CA 125.309 1.433 . . . . 0.0 111.929 175.003 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 mt -55.14 -54.74 39.38 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 117.739 0.77 . . . . 0.0 110.43 174.022 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.6 mp -58.84 -44.17 90.89 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 119.344 0.975 . . . . 0.0 111.756 -179.325 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 88.5 mt -55.94 -56.53 12.24 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 C-N-CA 123.398 0.679 . . . . 0.0 110.304 174.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.19 -50.08 64.15 Favored Glycine 0 CA--C 1.522 0.471 0 N-CA-C 110.046 -1.221 . . . . 0.0 110.046 -176.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 8.8 mm -52.94 -47.86 52.54 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.394 0 C-N-CA 123.465 0.706 . . . . 0.0 110.139 175.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 53.6 t80 -55.25 -65.15 0.64 Allowed 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 118.432 0.56 . . . . 0.0 109.74 177.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 25.5 m-70 -61.92 -26.79 68.39 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 118.41 -0.805 . . . . 0.0 113.018 -172.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 65.1 tttp -49.21 -35.99 18.78 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 119.366 0.984 . . . . 0.0 111.107 171.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 71.7 m-85 -103.6 -56.34 2.23 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 122.994 0.518 . . . . 0.0 110.084 177.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.5 m -54.9 -34.17 62.8 Favored 'General case' 0 C--O 1.225 -0.231 0 C-N-CA 122.988 0.515 . . . . 0.0 111.924 -176.257 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -48.03 -30.07 7.06 Favored Glycine 0 CA--C 1.529 0.925 0 C-N-CA 124.91 1.243 . . . . 0.0 113.496 176.169 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 32.8 mtmm -65.48 -34.98 79.54 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 118.266 1.033 . . . . 0.0 111.253 177.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -74.2 135.23 42.76 Favored 'General case' 0 N--CA 1.449 -0.485 0 N-CA-C 108.164 -1.05 . . . . 0.0 108.164 178.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -54.81 -45.17 80.61 Favored Glycine 0 CA--C 1.531 1.038 0 N-CA-C 109.622 -1.391 . . . . 0.0 109.622 172.063 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.1 p-10 -78.57 60.5 2.7 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.918 1.287 . . . . 0.0 109.453 172.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 3.2 ptmm? -65.57 -0.36 1.98 Allowed 'General case' 0 CA--C 1.54 0.563 0 N-CA-C 115.394 1.627 . . . . 0.0 115.394 -171.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 20.8 t-160 -77.32 -17.77 58.03 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.419 1.088 . . . . 0.0 110.378 169.315 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -131.17 156.76 44.77 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 126.542 1.937 . . . . 0.0 110.374 -170.199 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.56 173.5 15.42 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.099 0.96 . . . . 0.0 109.171 173.057 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 54.5 p -117.94 171.97 7.72 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 123.596 0.759 . . . . 0.0 112.28 -172.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 11.7 pttm -31.74 -49.17 0.16 Allowed 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 127.197 2.199 . . . . 0.0 113.416 169.28 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.5 -54.83 42.55 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 121.411 0.624 . . . . 0.0 109.533 -177.109 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 8.2 mp0 -60.62 -41.91 95.8 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.339 179.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 69.6 mt -59.16 -48.77 80.37 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-N 118.447 0.567 . . . . 0.0 111.405 178.519 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 62.4 mtpt -62.6 -31.57 72.43 Favored 'General case' 0 N--CA 1.457 -0.122 0 C-N-CA 123.397 0.679 . . . . 0.0 110.881 179.221 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.43 -68.83 0.34 Allowed 'General case' 0 C--O 1.22 -0.463 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 167.052 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.3 mt -30.13 -65.65 0.11 Allowed 'General case' 0 N--CA 1.464 0.25 0 C-N-CA 126.075 1.75 . . . . 0.0 113.266 -177.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 20.0 tt -59.34 -51.94 66.67 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.231 -175.105 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -57.84 -45.76 85.74 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 125.208 1.403 . . . . 0.0 111.91 -177.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 9.0 mmpt? -72.21 -48.89 39.6 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 124.982 1.313 . . . . 0.0 110.263 -175.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 64.1 mm-40 -92.58 -52.77 4.48 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 123.306 0.642 . . . . 0.0 111.052 -169.201 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 31.9 mt -82.67 64.6 7.39 Favored 'General case' 0 C--N 1.335 -0.05 0 N-CA-C 108.022 -1.103 . . . . 0.0 108.022 172.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 31.7 p -53.54 -67.9 0.22 Allowed 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.062 0.945 . . . . 0.0 109.768 179.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 53.5 mt 65.9 -60.9 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 C-N-CA 127.611 2.364 . . . . 0.0 112.735 172.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.19 -69.06 1.98 Allowed Glycine 0 CA--C 1.526 0.723 0 N-CA-C 109.649 -1.38 . . . . 0.0 109.649 -177.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 20.0 m -72.12 71.39 0.84 Allowed 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.98 0.912 . . . . 0.0 108.999 173.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 31.8 mttt -54.34 96.84 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 124.157 0.983 . . . . 0.0 111.263 -171.077 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 73.8 mt -37.3 -45.59 0.68 Allowed 'General case' 0 N--CA 1.462 0.163 0 C-N-CA 127.354 2.261 . . . . 0.0 113.804 -171.334 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -154.99 174.48 15.1 Favored 'General case' 0 N--CA 1.447 -0.603 0 N-CA-C 106.019 -1.845 . . . . 0.0 106.019 176.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -51.06 -30.59 16.21 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 124.914 1.286 . . . . 0.0 112.473 -177.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.31 -59.99 0.14 Allowed 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 126.984 2.114 . . . . 0.0 114.421 -176.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -63.63 -43.33 97.13 Favored 'General case' 0 CA--C 1.534 0.356 0 CA-C-O 121.119 0.485 . . . . 0.0 110.332 -173.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.644 HD12 ' H ' ' A' ' 53' ' ' ILE . 2.5 mp -63.1 -51.2 74.58 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.418 0 N-CA-C 107.264 -1.384 . . . . 0.0 107.264 -178.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 72.7 t -55.11 -49.32 72.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.351 0 C-N-CA 123.554 0.742 . . . . 0.0 109.867 178.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -53.79 -53.07 57.5 Favored 'General case' 0 CA--C 1.527 0.092 0 CA-C-N 118.826 0.739 . . . . 0.0 110.595 176.338 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.4 mt -51.14 -43.0 61.12 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 119.34 -0.362 . . . . 0.0 111.737 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.48 -68.07 0.48 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 118.411 0.55 . . . . 0.0 109.85 175.38 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -43.86 -35.12 1.83 Allowed 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 128.037 2.535 . . . . 0.0 112.689 -174.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -38.39 -48.68 1.38 Allowed 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 124.738 1.215 . . . . 0.0 112.585 171.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -65.21 -36.7 84.99 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 117.877 0.308 . . . . 0.0 111.349 -176.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -71.04 -43.99 66.71 Favored 'General case' 0 C--O 1.226 -0.135 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 179.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 22.5 ttm105 -56.75 -52.9 63.2 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 123.195 0.598 . . . . 0.0 110.18 175.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 5.6 m-80 -81.04 60.99 4.44 Favored 'General case' 0 C--O 1.233 0.214 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -177.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 17.5 ttmm -74.65 69.88 1.79 Allowed 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 124.107 0.963 . . . . 0.0 109.763 -176.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 48.5 m-20 52.6 43.89 30.69 Favored 'General case' 0 CA--C 1.528 0.101 0 C-N-CA 124.908 1.283 . . . . 0.0 109.898 -169.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 26.7 mm-40 -141.44 149.62 41.23 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 125.788 1.635 . . . . 0.0 107.036 175.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -86.14 172.57 10.46 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.292 1.037 . . . . 0.0 109.269 169.387 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.6 m -119.13 149.21 21.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 169.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.8 p30 -93.2 169.15 10.61 Favored 'General case' 0 C--O 1.232 0.169 0 C-N-CA 123.677 0.791 . . . . 0.0 110.096 172.115 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -34.63 -59.0 0.48 Allowed 'General case' 0 C--O 1.225 -0.192 0 C-N-CA 124.95 1.3 . . . . 0.0 113.261 176.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 34.6 tp60 -68.2 -29.25 68.05 Favored 'General case' 0 CA--C 1.528 0.116 0 O-C-N 120.848 -1.158 . . . . 0.0 111.464 -173.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.2 -31.7 66.12 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.408 -0.808 . . . . 0.0 110.063 174.085 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -61.16 -47.26 87.02 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 121.365 -0.834 . . . . 0.0 109.254 167.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 26.5 mm -59.96 -29.48 43.44 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.51 0 O-C-N 121.784 -0.572 . . . . 0.0 110.586 174.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 28.6 m -72.38 -39.15 68.25 Favored 'General case' 0 C--O 1.225 -0.195 0 O-C-N 121.26 -0.9 . . . . 0.0 111.225 172.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 48.1 t80 -58.83 -54.71 43.98 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 118.88 0.764 . . . . 0.0 109.454 174.414 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 29.2 mt -59.46 -44.97 92.88 Favored 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 122.477 0.311 . . . . 0.0 111.068 175.174 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -60.4 -39.86 96.79 Favored Glycine 0 CA--C 1.524 0.651 0 C-N-CA 123.727 0.679 . . . . 0.0 111.464 -178.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -68.99 -49.64 56.05 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.819 0.848 . . . . 0.0 110.057 176.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -47.38 -53.8 12.9 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.607 0.763 . . . . 0.0 109.731 173.632 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -54.62 -60.65 3.07 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 124.669 1.187 . . . . 0.0 110.6 176.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 53.9 ttm -48.93 -45.28 41.4 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 124.037 0.935 . . . . 0.0 111.333 -178.568 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 57.4 mt -65.82 -60.09 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-O 118.482 -0.77 . . . . 0.0 109.901 -178.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.379 0.0 OUTLIER -76.64 -31.61 57.48 Favored 'General case' 0 N--CA 1.469 0.491 0 N-CA-C 113.96 1.096 . . . . 0.0 113.96 -172.67 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 28.7 m120 -82.39 58.02 3.92 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 169.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -39.53 -40.44 0.86 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 127.251 2.22 . . . . 0.0 115.046 -168.285 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -45.9 -38.41 7.45 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.914 1.286 . . . . 0.0 112.375 178.581 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 93.0 mt -55.89 -28.85 58.6 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.514 0.561 . . . . 0.0 112.514 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -75.71 64.7 1.77 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.751 0.705 . . . . 0.0 109.609 174.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.148 0 CA-C-O 117.351 -1.805 . . . . 0.0 110.912 -177.02 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 24.9 ptm . . . . . 0 N--CA 1.475 0.822 0 N-CA-C 111.685 0.254 . . . . 0.0 111.685 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -81.34 67.34 7.24 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 122.894 0.478 . . . . 0.0 110.136 179.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.5 m -47.58 156.68 0.63 Allowed Pre-proline 0 CA--C 1.534 0.343 0 C-N-CA 126.245 1.818 . . . . 0.0 112.323 -179.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -41.65 -49.75 5.15 Favored 'Trans proline' 0 C--N 1.347 0.482 0 C-N-CA 123.947 3.098 . . . . 0.0 114.25 -177.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 4.5 mt -56.19 -51.08 69.34 Favored 'General case' 0 N--CA 1.457 -0.111 0 N-CA-C 113.175 0.806 . . . . 0.0 113.175 172.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 36.1 t70 -61.68 -36.68 81.58 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 118.353 0.524 . . . . 0.0 109.85 -178.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -59.97 -53.8 53.57 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 124.396 1.078 . . . . 0.0 109.551 175.617 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.05 -47.41 86.53 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.102 0.961 . . . . 0.0 111.148 -178.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 72.0 mt -52.84 -53.0 23.37 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.202 0 N-CA-C 108.561 -0.903 . . . . 0.0 108.561 170.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -49.29 -44.57 35.08 Favored Glycine 0 CA--C 1.525 0.676 0 C-N-CA 125.45 1.5 . . . . 0.0 111.882 176.864 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.1 mt -59.32 -54.45 46.67 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.651 0.78 . . . . 0.0 110.89 174.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 mp -58.49 -43.36 88.97 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 118.911 0.778 . . . . 0.0 111.43 179.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 85.4 mt -57.73 -52.65 55.04 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.207 0 C-N-CA 123.739 0.816 . . . . 0.0 110.611 173.012 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.25 -50.18 60.63 Favored Glycine 0 CA--C 1.523 0.551 0 N-CA-C 109.788 -1.325 . . . . 0.0 109.788 -177.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.9 mm -54.2 -50.81 53.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 C-N-CA 123.391 0.676 . . . . 0.0 110.387 175.216 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . 0.413 ' HB2' ' CE2' ' B' ' 73' ' ' TYR . 39.7 t80 -53.43 -56.59 15.58 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 121.699 0.762 . . . . 0.0 110.862 177.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 44.1 t60 -63.85 -37.4 87.25 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 124.573 1.149 . . . . 0.0 110.696 -171.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -49.67 -49.3 47.98 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.913 0.885 . . . . 0.0 110.91 175.006 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -88.42 -33.39 17.9 Favored 'General case' 0 CA--C 1.529 0.155 0 O-C-N 122.277 -0.264 . . . . 0.0 111.121 -174.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 14.6 m -63.46 -41.71 98.62 Favored 'General case' 0 CA--C 1.536 0.414 0 CA-C-N 118.346 0.521 . . . . 0.0 110.721 175.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -23.05 -60.53 0.03 OUTLIER Glycine 0 C--N 1.339 0.697 0 C-N-CA 128.433 2.921 . . . . 0.0 114.397 -179.284 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 58.7 pttt -58.46 -41.5 85.3 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -172.375 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -87.1 36.15 0.72 Allowed 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.542 0.942 . . . . 0.0 113.542 -168.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 71.68 -68.52 0.99 Allowed Glycine 0 CA--C 1.53 0.995 0 C-N-CA 123.681 0.658 . . . . 0.0 112.625 171.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -78.34 71.54 4.81 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 178.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 56.9 pttt -71.26 27.33 0.04 OUTLIER 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.612 1.565 . . . . 0.0 114.494 -171.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 18.0 m80 -128.94 11.15 6.03 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.964 1.705 . . . . 0.0 109.529 170.271 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 59.3 p -139.57 158.61 43.83 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 125.725 1.61 . . . . 0.0 107.624 172.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -161.4 179.01 8.61 Favored 'General case' 0 CA--C 1.529 0.136 0 CA-C-O 118.215 -0.898 . . . . 0.0 110.057 171.457 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.3 t -135.68 -165.74 1.74 Allowed 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 119.659 1.118 . . . . 0.0 112.441 -176.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 24.1 pttm -47.14 -52.05 16.52 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 126.575 1.95 . . . . 0.0 112.618 -170.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 18.8 tptp -52.1 -51.31 58.55 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 124.247 1.019 . . . . 0.0 110.825 178.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 27.9 mp0 -69.21 -36.5 77.31 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 116.037 -0.528 . . . . 0.0 110.282 -176.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 19.2 mt -66.03 -47.67 73.62 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 118.842 0.746 . . . . 0.0 111.429 176.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -57.69 -48.72 78.76 Favored 'General case' 0 CA--C 1.531 0.224 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 175.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 58.2 mt-10 -53.04 -58.34 7.32 Favored 'General case' 0 C--O 1.222 -0.384 0 CA-C-O 119.363 -0.351 . . . . 0.0 110.914 172.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 10.2 mt -44.46 -62.56 1.14 Allowed 'General case' 0 CA--C 1.521 -0.165 0 C-N-CA 124.521 1.128 . . . . 0.0 110.229 179.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 15.3 tt -63.35 -47.01 93.96 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 C-N-CA 120.064 -0.654 . . . . 0.0 110.449 -174.9 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 16.0 tt0 -60.13 -49.34 78.02 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 121.409 -0.807 . . . . 0.0 111.717 -177.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -73.85 -52.15 13.94 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.838 0.855 . . . . 0.0 109.766 -175.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -85.15 -18.75 33.19 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 112.412 0.523 . . . . 0.0 112.412 -169.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 15.6 mt -133.47 60.54 1.7 Allowed 'General case' 0 CA--C 1.53 0.192 0 C-N-CA 124.605 1.162 . . . . 0.0 108.364 175.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 7.0 p -52.51 -66.24 0.42 Allowed 'General case' 0 CA--C 1.528 0.106 0 C-N-CA 123.773 0.829 . . . . 0.0 109.66 174.164 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 62.8 mt 69.03 -51.1 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 C-N-CA 127.126 2.17 . . . . 0.0 112.312 175.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.13 -68.0 3.18 Favored Glycine 0 CA--C 1.523 0.564 0 N-CA-C 109.057 -1.617 . . . . 0.0 109.057 -178.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 42.5 p -75.12 69.06 1.97 Allowed 'General case' 0 N--CA 1.453 -0.302 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 170.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . 0.411 ' CB ' HD11 ' B' ' 53' ' ' ILE . 52.8 mttm -55.92 95.38 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.331 1.052 . . . . 0.0 110.875 -172.071 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 86.8 mt -46.65 118.07 1.88 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.667 1.587 . . . . 0.0 113.598 -169.17 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 69.43 -67.98 0.21 Allowed 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 126.767 2.027 . . . . 0.0 113.165 168.673 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 16.8 p-10 179.78 -37.32 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 125.967 1.707 . . . . 0.0 110.556 -171.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -37.69 -56.47 1.06 Allowed 'General case' 0 C--O 1.225 -0.209 0 C-N-CA 125.383 1.473 . . . . 0.0 113.874 -171.002 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -61.21 -40.36 93.67 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-O 121.275 0.56 . . . . 0.0 110.88 -175.257 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 53' ' ' ILE . . . . . 0.672 HD12 ' H ' ' B' ' 53' ' ' ILE . 2.4 mp -68.44 -49.85 62.1 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.636 0 N-CA-C 106.873 -1.528 . . . . 0.0 106.873 -177.144 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 92.9 t -53.83 -45.06 62.12 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.263 0 C-N-CA 123.239 0.616 . . . . 0.0 110.141 175.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -57.17 -52.74 64.09 Favored 'General case' 0 CA--C 1.527 0.075 0 CA-C-N 118.715 0.689 . . . . 0.0 110.235 175.512 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 30.9 mt -52.51 -41.36 63.37 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-O 119.038 -0.505 . . . . 0.0 111.419 178.375 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 27.6 mmt -68.94 -61.9 1.61 Allowed 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 118.926 0.785 . . . . 0.0 109.914 176.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -44.11 -36.38 2.57 Favored 'General case' 0 CA--C 1.522 -0.131 0 C-N-CA 127.724 2.41 . . . . 0.0 111.899 -177.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -38.86 -49.42 1.65 Allowed 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 124.542 1.137 . . . . 0.0 112.061 175.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -57.87 -53.77 54.49 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.342 0.519 . . . . 0.0 109.909 -178.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -60.95 -39.63 90.25 Favored 'General case' 0 C--O 1.226 -0.155 0 C-N-CA 124.352 1.061 . . . . 0.0 111.011 -178.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 36.0 ttm-85 -62.36 -54.94 33.06 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 123.473 0.709 . . . . 0.0 109.902 178.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 -69.8 -46.34 65.91 Favored 'General case' 0 CA--C 1.52 -0.206 0 CA-C-O 119.642 -0.218 . . . . 0.0 111.138 -173.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 47.8 mttp 52.23 36.13 18.61 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.272 0.558 . . . . 0.0 110.142 -169.029 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 37.4 m-20 57.47 24.82 10.69 Favored 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 125.705 1.602 . . . . 0.0 113.565 -174.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 69.4 mm-40 -101.97 159.92 14.94 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 123.632 0.773 . . . . 0.0 109.275 170.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 10.7 mp0 -77.63 115.98 17.82 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 124.615 1.166 . . . . 0.0 108.625 169.699 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 33.7 m -79.58 155.17 4.67 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 172.464 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 3.5 p30 -101.07 171.96 7.31 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-O 121.638 0.733 . . . . 0.0 110.527 171.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 59.4 t80 -31.8 -58.35 0.28 Allowed 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 126.627 1.971 . . . . 0.0 113.65 178.061 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 44.3 tp60 -65.9 -39.14 90.34 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 119.943 1.247 . . . . 0.0 112.201 -169.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -69.37 -38.78 78.22 Favored 'General case' 0 C--O 1.234 0.248 0 O-C-N 121.57 -0.706 . . . . 0.0 109.732 177.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 73' ' ' TYR . . . . . 0.413 ' CE2' ' HB2' ' B' ' 16' ' ' PHE . 1.0 OUTLIER -54.96 -55.47 30.37 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 171.77 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 19.3 mm -50.59 -48.34 26.89 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.26 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 178.336 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 34.2 m -59.88 -20.87 59.7 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 113.618 0.97 . . . . 0.0 113.618 -179.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 15.3 t80 -61.25 -49.31 77.62 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 119.48 1.036 . . . . 0.0 108.398 169.312 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 44.2 mt -71.3 -39.48 71.43 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.164 0.986 . . . . 0.0 110.936 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -58.31 -50.03 70.47 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.025 -1.23 . . . . 0.0 110.025 176.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.2 -45.68 93.58 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 122.817 0.447 . . . . 0.0 110.638 175.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 14.8 tp -51.46 -56.07 15.35 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 121.087 0.47 . . . . 0.0 110.075 177.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.42 -58.78 5.31 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 124.323 1.049 . . . . 0.0 109.896 175.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 55.6 ttm -50.63 -44.97 57.51 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 123.93 0.892 . . . . 0.0 111.315 -176.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 98.6 mt -70.19 -62.3 1.34 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 118.322 -0.846 . . . . 0.0 110.822 179.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.427 0.1 OUTLIER -71.38 -38.97 71.47 Favored 'General case' 0 C--N 1.347 0.476 0 C-N-CA 118.691 -1.204 . . . . 0.0 112.676 -170.919 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 69.5 m-80 -85.98 62.54 7.51 Favored 'General case' 0 C--N 1.335 -0.048 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 168.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -42.72 -36.84 1.56 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.709 1.604 . . . . 0.0 112.573 -176.233 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -31.87 -49.68 0.18 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 126.804 2.042 . . . . 0.0 112.7 169.506 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 17.3 mt -47.36 -40.77 18.19 Favored 'General case' 0 C--O 1.226 -0.183 0 C-N-CA 124.561 1.144 . . . . 0.0 112.608 -179.592 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -59.87 -24.59 64.38 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.222 0.465 . . . . 0.0 111.898 -177.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.16 0 CA-C-O 117.595 -1.67 . . . . 0.0 111.072 176.249 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 82.3 mtp . . . . . 0 N--CA 1.476 0.853 0 CA-C-O 120.892 0.377 . . . . 0.0 110.595 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -64.96 78.02 0.05 OUTLIER 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.702 1.201 . . . . 0.0 110.202 178.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 14.9 m -64.5 164.5 19.38 Favored Pre-proline 0 CA--C 1.539 0.557 0 C-N-CA 125.137 1.375 . . . . 0.0 110.013 -176.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_exo -47.61 -47.95 16.87 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 123.171 2.58 . . . . 0.0 113.042 -178.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.419 HD23 ' HA ' ' A' ' 5' ' ' LEU . 5.2 mt -56.4 -47.49 78.89 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-O 119.195 -0.431 . . . . 0.0 112.036 173.201 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -61.66 -41.34 97.41 Favored 'General case' 0 C--O 1.227 -0.11 0 CA-C-N 118.717 0.689 . . . . 0.0 109.649 -176.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.5 tt0 -62.03 -49.78 74.64 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 122.855 0.462 . . . . 0.0 110.826 175.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.8 -46.34 89.97 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.534 0.683 . . . . 0.0 111.423 -178.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 68.8 mt -53.7 -52.31 35.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.196 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 170.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.87 -47.35 19.25 Favored Glycine 0 CA--C 1.526 0.769 0 C-N-CA 125.204 1.383 . . . . 0.0 111.88 175.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 mt -55.69 -54.86 39.13 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 117.706 0.753 . . . . 0.0 110.958 173.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.11 -44.35 87.65 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 118.809 0.731 . . . . 0.0 111.742 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.425 HD11 ' HB1' ' B' ' 81' ' ' ALA . 83.1 mt -56.81 -53.8 37.59 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 C-N-CA 123.422 0.689 . . . . 0.0 110.003 174.467 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -53.88 -50.22 55.45 Favored Glycine 0 CA--C 1.523 0.538 0 N-CA-C 110.111 -1.196 . . . . 0.0 110.111 -178.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 7.3 mm -55.33 -46.48 78.29 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 123.269 0.628 . . . . 0.0 110.513 176.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -56.23 -57.88 10.31 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 118.738 0.699 . . . . 0.0 110.233 175.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -56.41 -37.14 69.76 Favored 'General case' 0 N--CA 1.452 -0.357 0 C-N-CA 124.158 0.983 . . . . 0.0 111.234 -175.352 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -51.04 -32.16 20.77 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.801 1.24 . . . . 0.0 111.903 178.271 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -108.61 -53.44 2.64 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.108 0.563 . . . . 0.0 110.233 177.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 23.1 t -53.04 -37.89 61.96 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.458 0.703 . . . . 0.0 110.921 -179.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -50.72 -24.93 8.46 Favored Glycine 0 CA--C 1.53 1.003 0 C-N-CA 124.157 0.884 . . . . 0.0 114.076 176.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 54.5 mttp -91.85 -12.12 34.54 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 118.227 1.013 . . . . 0.0 112.355 -178.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -73.89 164.91 26.02 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-N 118.423 0.556 . . . . 0.0 109.504 176.272 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -64.49 -62.14 5.35 Favored Glycine 0 CA--C 1.53 0.973 0 N-CA-C 109.475 -1.45 . . . . 0.0 109.475 172.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -80.99 93.79 6.42 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 108.373 -0.973 . . . . 0.0 108.373 170.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 49.9 mtmt -74.33 34.91 0.09 Allowed 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 123.907 0.883 . . . . 0.0 112.912 -176.308 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 10.6 m80 -125.07 -7.9 7.15 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 127.019 2.128 . . . . 0.0 109.85 176.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 41.6 p -133.68 170.56 15.38 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 125.057 1.343 . . . . 0.0 108.516 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -161.36 170.8 19.42 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.548 1.139 . . . . 0.0 108.212 169.144 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 59.9 p -127.22 173.97 9.31 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 119.343 0.974 . . . . 0.0 112.482 -169.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.4 ptmm? -26.48 -55.9 0.08 Allowed 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 128.339 2.656 . . . . 0.0 114.565 175.074 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 17.8 tppt? -55.63 -55.65 29.58 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 123.457 0.703 . . . . 0.0 110.233 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 7.7 mp0 -62.59 -35.64 80.16 Favored 'General case' 0 C--O 1.221 -0.396 0 CA-C-O 118.949 -0.548 . . . . 0.0 110.49 -179.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 51.7 mt -66.69 -50.22 63.58 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 118.755 0.707 . . . . 0.0 111.217 178.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -59.77 -43.73 94.22 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 110.094 -0.335 . . . . 0.0 110.094 177.159 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -55.9 -64.83 0.73 Allowed 'General case' 0 C--O 1.219 -0.508 0 CA-C-O 118.467 -0.778 . . . . 0.0 109.646 170.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.3 mt -35.56 -62.16 0.42 Allowed 'General case' 0 N--CA 1.461 0.112 0 C-N-CA 125.42 1.488 . . . . 0.0 111.499 179.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 9.2 tt -60.81 -51.58 71.54 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 C-N-CA 120.292 -0.563 . . . . 0.0 109.866 -174.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 18.9 tt0 -60.61 -42.4 96.76 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 121.588 -0.695 . . . . 0.0 112.443 -177.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -72.67 -55.04 7.42 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.93 1.292 . . . . 0.0 109.534 -175.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 60.3 mm-40 -85.97 -24.97 26.3 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.735 0.814 . . . . 0.0 113.005 -168.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 67.9 mt -105.58 91.45 3.77 Favored 'General case' 0 C--N 1.338 0.099 0 N-CA-C 107.239 -1.393 . . . . 0.0 107.239 168.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 60.9 p -78.14 50.7 0.92 Allowed 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.175 0.99 . . . . 0.0 109.479 -179.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 69.4 mt -92.38 81.84 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 N-CA-C 106.824 -1.547 . . . . 0.0 106.824 -173.381 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -55.63 -49.33 65.96 Favored Glycine 0 CA--C 1.529 0.922 0 N-CA-C 109.701 -1.359 . . . . 0.0 109.701 173.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 7.2 m -71.82 69.54 0.69 Allowed 'General case' 0 N--CA 1.453 -0.311 0 C-N-CA 124.213 1.005 . . . . 0.0 110.07 172.104 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 30.8 mmtp -45.73 95.44 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 126.151 1.781 . . . . 0.0 111.289 -178.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 93.8 mt -58.73 120.23 8.57 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.471 1.109 . . . . 0.0 113.515 -169.265 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 56.66 -96.56 0.06 Allowed 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 125.873 1.669 . . . . 0.0 112.303 166.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -142.12 -40.3 0.36 Allowed 'General case' 0 N--CA 1.462 0.125 0 C-N-CA 124.076 0.951 . . . . 0.0 111.283 179.22 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -34.16 -57.98 0.47 Allowed 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 125.181 1.392 . . . . 0.0 113.81 -173.396 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 77.1 tt0 -66.04 -40.94 91.42 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.975 0.51 . . . . 0.0 111.486 -174.092 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.603 HD12 ' H ' ' A' ' 53' ' ' ILE . 2.2 mp -63.05 -52.69 56.0 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.46 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 -179.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 77.6 t -54.36 -48.27 68.42 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.466 0 C-N-CA 123.975 0.91 . . . . 0.0 109.877 177.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 3.4 mptp? -53.56 -52.94 58.1 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 118.871 0.759 . . . . 0.0 111.112 177.091 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 30.9 mt -52.59 -42.88 64.92 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-O 119.378 -0.344 . . . . 0.0 111.462 -179.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.52 -63.54 1.1 Allowed 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 118.457 0.571 . . . . 0.0 109.873 176.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -38.93 -46.35 1.3 Allowed 'General case' 0 CA--C 1.521 -0.141 0 C-N-CA 127.327 2.251 . . . . 0.0 111.818 -177.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -38.91 -48.81 1.62 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.701 1.2 . . . . 0.0 112.6 177.064 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.1 mp -57.39 -51.56 68.91 Favored 'General case' 0 N--CA 1.455 -0.179 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 -177.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -65.94 -40.99 91.87 Favored 'General case' 0 C--O 1.225 -0.231 0 C-N-CA 122.654 0.382 . . . . 0.0 110.764 179.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 12.7 ttp180 -60.07 -41.76 93.08 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 122.842 0.457 . . . . 0.0 110.568 -178.072 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -87.37 -59.77 2.16 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-O 120.858 0.361 . . . . 0.0 111.333 -177.208 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 54.4 mttp 63.31 -73.04 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 126.005 1.722 . . . . 0.0 108.708 -166.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 14.1 m-20 -138.05 -17.66 1.21 Allowed 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.94 1.696 . . . . 0.0 111.765 172.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 59.9 tp60 -71.37 129.7 39.48 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-N 118.703 0.683 . . . . 0.0 109.809 -174.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 21.1 mp0 -73.99 131.91 41.87 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 108.123 -1.066 . . . . 0.0 108.123 171.532 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 10.7 m -83.19 150.71 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.251 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 176.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 4.9 p-10 -89.64 177.07 6.63 Favored 'General case' 0 C--O 1.232 0.163 0 C-N-CA 123.267 0.627 . . . . 0.0 110.693 175.058 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 77.6 t80 -44.43 -60.86 1.75 Allowed 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 123.84 0.856 . . . . 0.0 111.861 174.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.0 tp60 -62.49 -35.81 80.53 Favored 'General case' 0 C--O 1.225 -0.19 0 CA-C-N 119.376 0.989 . . . . 0.0 111.822 -173.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -65.51 -40.53 93.12 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 119.519 1.054 . . . . 0.0 111.277 174.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -55.62 -51.77 66.07 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.801 -0.562 . . . . 0.0 109.525 170.345 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 29.0 mm -56.53 -39.91 65.03 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 O-C-N 122.029 -0.419 . . . . 0.0 110.335 177.216 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 84.8 m -64.19 -39.59 94.31 Favored 'General case' 0 C--O 1.226 -0.151 0 O-C-N 121.614 -0.679 . . . . 0.0 110.384 178.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 26.6 t80 -55.27 -53.33 57.45 Favored 'General case' 0 CA--C 1.533 0.304 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 173.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 61.7 mt -60.32 -42.35 95.42 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 116.673 -0.24 . . . . 0.0 111.572 177.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -62.31 -46.9 92.93 Favored Glycine 0 CA--C 1.526 0.768 0 N-CA-C 110.862 -0.895 . . . . 0.0 110.862 -179.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.6 -48.83 77.72 Favored 'General case' 0 N--CA 1.45 -0.473 0 O-C-N 122.173 -0.604 . . . . 0.0 109.758 177.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 16.7 tp -50.37 -57.96 6.78 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-O 121.72 0.772 . . . . 0.0 110.029 176.052 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.447 ' HB1' HD11 ' B' ' 13' ' ' ILE . . . -48.42 -54.88 12.46 Favored 'General case' 0 N--CA 1.446 -0.633 0 C-N-CA 125.109 1.364 . . . . 0.0 109.955 177.772 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 9.1 ttp -59.99 -48.31 82.24 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 123.342 0.657 . . . . 0.0 111.655 -176.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.404 HD13 HG21 ' A' ' 83' ' ' ILE . 93.7 mt -59.55 -54.28 36.67 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 CA-C-O 118.135 -0.936 . . . . 0.0 110.128 -179.033 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.439 1.3 p90 -76.41 -38.72 55.18 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 120.097 1.317 . . . . 0.0 113.309 -175.742 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 27.8 m-80 -79.88 74.19 6.62 Favored 'General case' 0 N--CA 1.463 0.206 0 O-C-N 121.008 -1.058 . . . . 0.0 108.552 173.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -36.33 -43.19 0.36 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.309 1.444 . . . . 0.0 113.512 176.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -39.97 -41.96 1.29 Allowed 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.11 1.764 . . . . 0.0 113.54 174.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 47.6 mt -62.71 -28.41 69.93 Favored 'General case' 0 CA--C 1.528 0.129 0 CA-C-O 118.864 -0.589 . . . . 0.0 112.349 -178.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.62 58.5 1.8 Allowed 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.553 1.07 . . . . 0.0 109.178 170.194 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.313 0 CA-C-O 116.38 -2.344 . . . . 0.0 110.256 179.547 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.915 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -71.26 78.06 0.72 Allowed 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.408 0.683 . . . . 0.0 111.005 -177.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.1 m -54.89 163.23 1.53 Allowed Pre-proline 0 CA--C 1.54 0.587 0 C-N-CA 124.686 1.194 . . . . 0.0 111.698 175.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 81.7 Cg_exo -46.89 -50.33 10.99 Favored 'Trans proline' 0 N--CA 1.459 -0.535 0 C-N-CA 123.597 2.864 . . . . 0.0 113.185 179.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.2 mt -54.73 -48.6 72.34 Favored 'General case' 0 C--O 1.225 -0.204 0 CA-C-O 119.476 -0.297 . . . . 0.0 111.535 173.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -61.4 -42.38 98.63 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 118.315 0.507 . . . . 0.0 109.973 -176.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.2 tp60 -63.64 -47.22 82.23 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 122.367 0.267 . . . . 0.0 110.922 176.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.5 -47.19 82.75 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 121.339 0.59 . . . . 0.0 110.869 -178.012 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 69.5 mt -52.68 -55.34 11.76 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.248 0 N-CA-C 108.075 -1.084 . . . . 0.0 108.075 169.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -45.77 -45.97 13.41 Favored Glycine 0 CA--C 1.526 0.772 0 C-N-CA 125.352 1.453 . . . . 0.0 112.079 177.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.2 mt -55.72 -55.92 26.6 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.493 0.717 . . . . 0.0 110.782 173.371 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.9 mp -58.51 -43.03 88.97 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 118.898 0.772 . . . . 0.0 111.863 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . 0.447 HD11 ' HB1' ' A' ' 81' ' ' ALA . 52.1 mt -57.48 -57.76 8.88 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 C-N-CA 123.435 0.694 . . . . 0.0 109.938 174.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.06 -48.84 61.53 Favored Glycine 0 CA--C 1.521 0.421 0 N-CA-C 109.968 -1.253 . . . . 0.0 109.968 -177.164 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 5.8 mm -54.22 -46.88 68.32 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.359 0 C-N-CA 123.515 0.726 . . . . 0.0 110.878 175.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 50.2 t80 -56.62 -61.42 2.44 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 118.719 0.69 . . . . 0.0 109.32 175.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -55.02 -37.33 66.51 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.727 0.811 . . . . 0.0 111.771 -173.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -45.68 -38.95 7.35 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.289 1.435 . . . . 0.0 111.197 175.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -101.56 -60.15 1.58 Allowed 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 109.667 -0.494 . . . . 0.0 109.667 176.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 2.5 m -50.63 -34.26 25.51 Favored 'General case' 0 C--N 1.338 0.091 0 C-N-CA 123.845 0.858 . . . . 0.0 112.617 -173.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -36.53 -48.35 1.24 Allowed Glycine 0 CA--C 1.527 0.786 0 C-N-CA 124.616 1.103 . . . . 0.0 112.745 173.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 10.6 ptpt -76.71 -13.94 59.99 Favored 'General case' 0 CA--C 1.533 0.296 0 N-CA-C 113.191 0.812 . . . . 0.0 113.191 -171.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -74.53 -7.32 52.71 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.405 0.548 . . . . 0.0 112.046 -175.097 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 77.92 -60.77 3.78 Favored Glycine 0 CA--C 1.527 0.799 0 N-CA-C 109.421 -1.471 . . . . 0.0 109.421 -176.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -78.18 70.29 4.52 Favored 'General case' 0 N--CA 1.456 -0.166 0 N-CA-C 106.81 -1.552 . . . . 0.0 106.81 169.323 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 7.1 mttp -63.22 -7.84 6.91 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 124.433 1.093 . . . . 0.0 113.92 -169.61 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 11.9 t-80 -76.0 -15.42 60.15 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.877 0.871 . . . . 0.0 110.994 173.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 1.1 p -129.65 160.99 31.62 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 125.374 1.469 . . . . 0.0 110.715 -173.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -156.51 161.37 40.02 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 123.081 0.552 . . . . 0.0 111.449 169.496 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 75.5 m -108.2 158.76 17.16 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 124.649 1.18 . . . . 0.0 113.145 -174.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 14.5 ptpt -22.64 -58.35 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 129.048 2.939 . . . . 0.0 115.397 179.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 18.2 tppt? -46.52 -50.04 17.72 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.24 1.016 . . . . 0.0 111.094 179.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 80.1 mt-10 -69.67 -27.94 65.45 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-O 119.037 -0.506 . . . . 0.0 111.847 -178.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 19.7 mt -73.9 -46.37 44.92 Favored 'General case' 0 CA--C 1.529 0.147 0 CA-C-N 119.153 0.888 . . . . 0.0 110.049 176.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 39.0 mttp -56.16 -47.87 77.41 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 109.848 -0.427 . . . . 0.0 109.848 172.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -55.04 -56.62 17.77 Favored 'General case' 0 C--O 1.223 -0.336 0 CA-C-O 119.044 -0.503 . . . . 0.0 111.037 172.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 11.1 mt -45.95 -59.56 2.76 Favored 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 123.38 0.672 . . . . 0.0 110.299 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 15.5 tt -62.91 -50.76 78.36 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 C-N-CA 119.8 -0.76 . . . . 0.0 110.197 -177.008 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 19.4 tt0 -59.35 -51.1 71.39 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.078 -1.014 . . . . 0.0 112.302 -175.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.1 -52.82 12.82 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 123.736 0.815 . . . . 0.0 110.208 -177.091 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -88.99 -18.15 27.97 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 113.392 0.886 . . . . 0.0 113.392 -167.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 42.6 mt -123.37 68.46 1.01 Allowed 'General case' 0 CA--C 1.526 0.054 0 C-N-CA 125.255 1.422 . . . . 0.0 107.874 172.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 74.8 p -55.68 -57.08 13.49 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.677 -176.33 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 80.2 mt 67.65 -61.51 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 C-N-CA 126.89 2.076 . . . . 0.0 111.982 172.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.14 -66.27 2.23 Favored Glycine 0 CA--C 1.527 0.812 0 N-CA-C 110.154 -1.178 . . . . 0.0 110.154 -177.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 36.0 p -70.47 78.93 0.56 Allowed 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 123.745 0.818 . . . . 0.0 109.032 173.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 31.3 mmtm -39.09 95.47 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 126.455 1.902 . . . . 0.0 111.597 178.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 95.6 mt -65.83 84.56 0.08 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.742 1.217 . . . . 0.0 112.308 -169.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 71.62 -66.86 0.28 Allowed 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 126.937 2.095 . . . . 0.0 113.001 167.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 18.1 p-10 -164.83 -46.66 0.03 OUTLIER 'General case' 0 C--O 1.225 -0.231 0 C-N-CA 123.705 0.802 . . . . 0.0 111.054 -169.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -42.52 -54.45 3.9 Favored 'General case' 0 C--O 1.225 -0.188 0 C-N-CA 123.912 0.885 . . . . 0.0 113.182 -169.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -59.42 -43.46 93.05 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.675 0.79 . . . . 0.0 110.848 -178.058 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 53' ' ' ILE . . . . . 0.56 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.2 mp -63.22 -52.53 57.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 N-CA-C 106.927 -1.508 . . . . 0.0 106.927 -178.389 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 84.7 t -56.72 -43.93 80.43 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.389 0 C-N-CA 124.248 1.019 . . . . 0.0 110.295 179.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -57.29 -53.7 55.17 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 119.023 0.829 . . . . 0.0 110.03 175.13 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 30.8 mt -51.88 -44.16 63.62 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 119.184 -0.436 . . . . 0.0 111.088 178.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 27.2 mmt -65.97 -65.31 0.69 Allowed 'General case' 0 CA--C 1.538 0.481 0 N-CA-C 109.524 -0.546 . . . . 0.0 109.524 176.116 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -40.72 -43.09 1.89 Allowed 'General case' 0 CA--C 1.52 -0.196 0 C-N-CA 127.826 2.45 . . . . 0.0 111.89 -175.155 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -38.7 -48.76 1.52 Allowed 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.21 1.004 . . . . 0.0 112.312 176.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.4 pp -61.85 -37.84 85.99 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 117.915 0.325 . . . . 0.0 111.479 -175.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -76.18 -47.15 25.19 Favored 'General case' 0 N--CA 1.455 -0.193 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 179.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 14.1 ttm180 -50.57 -41.46 54.34 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.244 0.617 . . . . 0.0 110.283 177.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 8.8 m-80 -82.94 19.79 1.31 Allowed 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 113.591 0.96 . . . . 0.0 113.591 -179.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 39.2 mtmt -58.36 -33.07 69.15 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 120.156 1.344 . . . . 0.0 108.471 166.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -74.74 12.4 0.83 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.334 1.054 . . . . 0.0 112.788 172.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 32.4 mt-30 72.62 -45.36 0.62 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 126.998 2.119 . . . . 0.0 113.214 177.201 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 22.7 pt-20 -139.79 162.43 35.17 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.655 1.182 . . . . 0.0 109.572 178.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 5.3 m -118.77 149.86 21.15 Favored 'Isoleucine or valine' 0 C--O 1.234 0.248 0 C-N-CA 124.991 1.316 . . . . 0.0 107.619 172.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 8.7 p30 -86.84 174.62 8.66 Favored 'General case' 0 CA--C 1.527 0.093 0 C-N-CA 124.272 1.029 . . . . 0.0 111.79 176.219 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 49.3 t80 -46.31 -61.91 1.58 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 123.717 0.807 . . . . 0.0 113.156 178.015 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 10.1 tp-100 -63.8 -32.49 74.02 Favored 'General case' 0 N--CA 1.463 0.225 0 CA-C-N 120.183 1.356 . . . . 0.0 111.071 -177.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -62.61 -41.7 99.14 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 119.533 1.061 . . . . 0.0 110.938 175.079 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -57.96 -50.51 73.14 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.769 -0.582 . . . . 0.0 109.892 169.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 23.9 mm -60.18 -25.21 32.79 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.589 0 O-C-N 121.655 -0.653 . . . . 0.0 111.04 176.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 60.8 m -77.88 -32.94 52.15 Favored 'General case' 0 C--O 1.224 -0.24 0 O-C-N 120.917 -1.115 . . . . 0.0 110.37 173.4 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 30.8 t80 -58.46 -55.25 37.47 Favored 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 170.293 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 53.1 mt -63.09 -43.19 99.21 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-O 121.411 0.624 . . . . 0.0 111.7 178.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.88 -43.7 97.18 Favored Glycine 0 CA--C 1.525 0.666 0 N-CA-C 110.685 -0.966 . . . . 0.0 110.685 -177.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.29 -46.74 85.37 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 123.186 0.595 . . . . 0.0 110.031 174.253 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 13.8 tp -49.55 -56.18 10.82 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.426 0.631 . . . . 0.0 109.963 175.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . 0.425 ' HB1' HD11 ' A' ' 13' ' ' ILE . . . -51.81 -58.63 5.87 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 114.624 -1.171 . . . . 0.0 110.384 177.438 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 48.3 ttm -51.01 -48.4 61.43 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 124.889 1.276 . . . . 0.0 110.983 -177.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 76.6 mt -63.8 -66.07 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.427 0 CA-C-O 118.8 -0.619 . . . . 0.0 109.458 -178.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.381 0.7 OUTLIER -70.13 -31.29 68.74 Favored 'General case' 0 C--N 1.345 0.411 0 C-N-CA 117.941 -1.504 . . . . 0.0 112.715 -169.764 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 22.5 m-80 -80.61 71.73 7.5 Favored 'General case' 0 C--O 1.231 0.12 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 170.03 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -35.75 -45.22 0.37 Allowed 'General case' 0 N--CA 1.463 0.223 0 C-N-CA 125.821 1.648 . . . . 0.0 112.158 178.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -35.74 -48.61 0.55 Allowed 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.968 1.707 . . . . 0.0 113.426 174.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 96.4 mt -65.06 -26.91 68.44 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 123.002 0.521 . . . . 0.0 112.393 -176.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 9.6 mtmp? -86.6 -47.32 9.3 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 123.381 0.672 . . . . 0.0 109.419 174.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.202 0 CA-C-O 116.883 -2.065 . . . . 0.0 110.262 -179.005 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 28.4 ttt . . . . . 0 N--CA 1.473 0.723 0 CA-C-O 121.382 0.611 . . . . 0.0 109.986 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -72.75 78.53 1.12 Allowed 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.025 0.53 . . . . 0.0 110.917 -176.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.4 t -44.87 155.63 0.39 Allowed Pre-proline 0 CA--C 1.534 0.336 0 C-N-CA 124.989 1.316 . . . . 0.0 111.08 169.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -50.23 -38.92 52.45 Favored 'Trans proline' 0 N--CA 1.454 -0.807 0 C-N-CA 122.331 2.021 . . . . 0.0 111.533 169.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.9 mt -61.28 -54.0 49.62 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 118.649 0.659 . . . . 0.0 110.142 173.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -58.35 -38.96 78.26 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 117.656 0.207 . . . . 0.0 110.832 -175.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 15.1 tt0 -64.02 -52.3 60.12 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 124.783 1.233 . . . . 0.0 110.615 176.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.34 -45.42 91.29 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 121.367 0.603 . . . . 0.0 111.098 -178.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 68.0 mt -52.63 -52.63 25.43 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 169.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.4 -47.47 16.78 Favored Glycine 0 CA--C 1.528 0.893 0 C-N-CA 125.204 1.383 . . . . 0.0 112.202 174.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.6 mt -56.89 -55.31 36.08 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 117.95 0.875 . . . . 0.0 110.8 174.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.9 mp -59.37 -42.8 92.47 Favored 'General case' 0 CA--C 1.539 0.546 0 CA-C-N 118.707 0.685 . . . . 0.0 111.7 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 73.5 mt -55.94 -56.82 10.71 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.167 0 C-N-CA 123.959 0.904 . . . . 0.0 109.746 172.659 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.29 -48.58 63.5 Favored Glycine 0 CA--C 1.522 0.518 0 N-CA-C 110.292 -1.123 . . . . 0.0 110.292 -176.577 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 6.3 mm -54.73 -46.63 74.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 C-N-CA 123.396 0.678 . . . . 0.0 110.527 175.166 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 31.8 t80 -57.95 -53.45 58.04 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 121.645 0.736 . . . . 0.0 110.187 175.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.5 t-80 -57.43 -36.61 71.58 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.673 0.789 . . . . 0.0 111.302 -175.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.8 ttmm -52.86 -28.5 23.29 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.026 1.33 . . . . 0.0 111.87 178.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 61.3 m-85 -117.61 -73.52 0.64 Allowed 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 123.36 0.664 . . . . 0.0 109.602 176.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -53.35 -48.77 68.23 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 124.513 1.125 . . . . 0.0 110.432 -175.683 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -65.63 -4.84 20.74 Favored Glycine 0 CA--C 1.522 0.53 0 CA-C-O 118.598 -1.112 . . . . 0.0 113.615 -175.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 13.5 mmmm -85.41 -31.19 23.02 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 118.961 1.381 . . . . 0.0 111.103 173.853 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -82.77 152.04 25.88 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 118.623 0.647 . . . . 0.0 109.271 176.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -54.55 -40.29 69.38 Favored Glycine 0 CA--C 1.528 0.906 0 C-N-CA 123.436 0.541 . . . . 0.0 111.952 -173.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 11.8 p-10 -79.07 62.05 3.38 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.014 0.926 . . . . 0.0 109.15 174.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -52.27 -28.84 20.38 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.366 1.466 . . . . 0.0 113.208 -169.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 20.1 t-160 -76.25 -14.14 60.14 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.6 1.56 . . . . 0.0 111.656 -176.422 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.5 p -131.64 159.88 37.02 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 124.015 0.926 . . . . 0.0 112.178 -169.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.48 -172.31 3.5 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.411 1.484 . . . . 0.0 108.178 171.178 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 8.6 t -148.17 -168.93 3.21 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 119.899 1.227 . . . . 0.0 111.828 178.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 49.0 pttt -35.15 -57.14 0.58 Allowed 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 128.992 2.917 . . . . 0.0 114.376 -173.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 23.1 ttmm -58.3 -52.37 65.88 Favored 'General case' 0 N--CA 1.452 -0.35 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 -177.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 42.5 mm-40 -63.22 -40.48 97.59 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.274 -176.54 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 56.2 mt -59.77 -52.71 64.32 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 118.133 0.424 . . . . 0.0 111.178 175.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 35.3 mtmm -59.91 -43.36 94.92 Favored 'General case' 0 CA--C 1.531 0.212 0 O-C-N 122.202 -0.311 . . . . 0.0 110.706 -179.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 85.1 mt-10 -56.87 -60.22 3.89 Favored 'General case' 0 C--O 1.219 -0.504 0 CA-C-O 118.746 -0.645 . . . . 0.0 109.8 172.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.0 mt -40.11 -60.6 1.02 Allowed 'General case' 0 N--CA 1.461 0.096 0 C-N-CA 124.481 1.113 . . . . 0.0 111.323 179.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 18.3 tt -60.94 -51.54 72.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 C-N-CA 120.179 -0.608 . . . . 0.0 110.29 -177.068 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -59.92 -47.55 85.3 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 118.868 0.758 . . . . 0.0 111.815 -175.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.2 mmpt? -67.95 -57.98 5.29 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 125.539 1.535 . . . . 0.0 109.642 -176.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 56.2 mm-40 -83.25 -49.23 9.63 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.198 -168.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 15.0 mt -82.46 63.77 6.79 Favored 'General case' 0 C--O 1.231 0.086 0 N-CA-C 108.056 -1.091 . . . . 0.0 108.056 171.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.2 t -74.61 56.48 0.69 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.434 1.094 . . . . 0.0 109.579 174.08 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 16.2 mt -70.14 -40.99 78.89 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 C-N-CA 123.993 0.917 . . . . 0.0 109.045 176.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.0 -66.14 2.19 Favored Glycine 0 C--N 1.338 0.693 0 N-CA-C 110.413 -1.075 . . . . 0.0 110.413 179.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 49.8 m -72.27 71.46 0.89 Allowed 'General case' 0 N--CA 1.456 -0.159 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 170.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 46.2 mttm -52.46 97.12 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.673 1.189 . . . . 0.0 111.113 -173.084 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.4 mt -56.57 128.35 35.83 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.529 1.131 . . . . 0.0 112.842 -169.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? 60.65 -93.72 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.803 1.641 . . . . 0.0 111.841 168.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -148.42 -37.87 0.18 Allowed 'General case' 0 CA--C 1.528 0.133 0 C-N-CA 124.044 0.938 . . . . 0.0 111.761 177.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.92 -60.5 0.16 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.124 1.77 . . . . 0.0 115.115 -176.2 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -62.55 -40.18 95.99 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-O 121.421 0.629 . . . . 0.0 110.845 -174.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.649 HD12 ' H ' ' A' ' 53' ' ' ILE . 3.4 mp -67.54 -48.42 76.94 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.619 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 -178.936 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 84.6 t -55.13 -44.66 75.53 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.36 0 CA-C-O 118.791 -0.623 . . . . 0.0 110.294 176.357 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -57.09 -52.68 64.33 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 119.339 0.972 . . . . 0.0 110.577 174.01 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 39.7 mt -52.99 -42.12 65.26 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 119.06 -0.495 . . . . 0.0 111.557 178.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 25.4 mmt -68.63 -61.56 1.77 Allowed 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.886 0.766 . . . . 0.0 109.554 176.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -46.12 -36.04 5.51 Favored 'General case' 0 CA--C 1.521 -0.143 0 C-N-CA 127.639 2.375 . . . . 0.0 111.973 -176.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -39.16 -56.75 1.43 Allowed 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 123.831 0.853 . . . . 0.0 111.605 170.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.25 -50.08 74.85 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 -176.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -58.25 -54.9 41.73 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 123.522 0.729 . . . . 0.0 111.189 -177.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 16.9 ptt180 -70.24 -43.15 71.17 Favored 'General case' 0 N--CA 1.454 -0.266 0 O-C-N 122.493 -0.129 . . . . 0.0 110.789 -173.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 22.8 m120 -75.71 -57.73 3.71 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 119.251 -0.404 . . . . 0.0 110.405 -177.368 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . 0.319 16.9 ptpt 52.26 -73.84 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.659 1.584 . . . . 0.0 112.386 -167.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 22.9 m-20 -146.91 35.08 0.92 Allowed 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.894 1.277 . . . . 0.0 110.373 170.059 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 58.7 tp60 -119.74 137.56 53.87 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 125.421 1.488 . . . . 0.0 109.697 -175.215 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.8 mp0 -77.7 141.92 39.08 Favored 'General case' 0 N--CA 1.451 -0.38 0 C-N-CA 124.193 0.997 . . . . 0.0 109.05 172.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 33.9 m -105.73 154.56 6.96 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 N-CA-C 108.239 -1.022 . . . . 0.0 108.239 170.071 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -93.35 178.11 5.82 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 123.946 0.898 . . . . 0.0 110.967 177.114 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 50.3 t80 -40.51 -65.41 0.42 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.756 1.222 . . . . 0.0 112.538 172.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 -61.21 -36.54 80.19 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 120.074 1.306 . . . . 0.0 111.844 -175.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 -66.55 -32.87 74.48 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 120.956 -1.09 . . . . 0.0 111.628 176.089 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -61.61 -51.89 66.65 Favored 'General case' 0 CA--C 1.53 0.183 0 O-C-N 121.19 -0.944 . . . . 0.0 108.559 168.499 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 21.3 mm -53.02 -39.69 33.91 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.364 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 177.713 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 54.6 m -59.1 -32.83 70.18 Favored 'General case' 0 C--O 1.226 -0.167 0 C-N-CA 123.744 0.818 . . . . 0.0 111.301 177.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -56.97 -50.55 72.3 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 171.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 42.9 mt -69.83 -39.82 76.24 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 124.018 0.927 . . . . 0.0 111.755 -177.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.72 -43.04 77.45 Favored Glycine 0 CA--C 1.524 0.64 0 N-CA-C 109.925 -1.27 . . . . 0.0 109.925 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.47 -45.95 88.44 Favored 'General case' 0 N--CA 1.452 -0.342 0 O-C-N 122.104 -0.644 . . . . 0.0 110.202 173.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 10.0 tp -50.53 -57.69 7.54 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 123.04 0.536 . . . . 0.0 109.708 173.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -49.67 -54.14 20.36 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 124.072 0.949 . . . . 0.0 110.533 177.12 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 48.1 ttm -56.16 -47.94 77.27 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 124.248 1.019 . . . . 0.0 110.906 -177.116 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 85.5 mt -65.48 -55.43 20.05 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.53 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.477 -177.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.444 0.1 OUTLIER -75.22 -35.8 61.44 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 119.911 1.232 . . . . 0.0 112.997 -174.408 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 31.9 m-80 -81.75 72.85 8.8 Favored 'General case' 0 N--CA 1.461 0.105 0 O-C-N 120.942 -1.099 . . . . 0.0 108.123 170.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -30.17 -50.77 0.13 Allowed 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 126.633 1.973 . . . . 0.0 112.837 -179.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -34.11 -54.46 0.49 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 126.202 1.801 . . . . 0.0 113.146 174.264 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 94.7 mt -65.72 -7.17 14.17 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.086 0.954 . . . . 0.0 113.245 -173.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -69.82 -31.53 69.46 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 120.005 1.275 . . . . 0.0 110.104 169.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.127 0 CA-C-O 116.949 -2.029 . . . . 0.0 111.061 -177.42 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.801 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -58.62 86.32 0.01 OUTLIER 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.838 1.255 . . . . 0.0 110.066 173.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -71.07 170.29 11.94 Favored Pre-proline 0 CA--C 1.539 0.526 0 C-N-CA 124.616 1.167 . . . . 0.0 111.101 -169.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -49.09 -49.01 16.37 Favored 'Trans proline' 0 N--CA 1.459 -0.554 0 C-N-CA 123.313 2.675 . . . . 0.0 112.428 179.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.5 mt -53.7 -50.9 64.88 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 119.32 -0.372 . . . . 0.0 111.551 172.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -59.38 -41.23 88.86 Favored 'General case' 0 C--O 1.227 -0.11 0 CA-C-N 118.539 0.608 . . . . 0.0 110.285 -177.376 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -61.66 -50.32 72.98 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 122.832 0.453 . . . . 0.0 110.69 176.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.21 -46.13 90.8 Favored 'General case' 0 CA--C 1.538 0.481 0 C-N-CA 123.597 0.759 . . . . 0.0 111.164 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 78.5 mt -55.64 -50.87 64.18 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 172.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.69 -47.68 18.11 Favored Glycine 0 CA--C 1.527 0.787 0 C-N-CA 125.295 1.426 . . . . 0.0 111.896 174.438 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.3 mt -55.52 -54.59 42.06 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 117.538 0.669 . . . . 0.0 111.087 173.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.5 mp -58.21 -42.76 86.93 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-N 118.851 0.751 . . . . 0.0 111.616 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 97.4 mt -56.98 -53.32 44.48 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.168 0 C-N-CA 123.204 0.602 . . . . 0.0 110.082 173.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.77 -50.06 59.42 Favored Glycine 0 CA--C 1.522 0.525 0 N-CA-C 110.33 -1.108 . . . . 0.0 110.33 -178.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.8 mm -55.02 -45.84 76.96 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 C-N-CA 122.607 0.363 . . . . 0.0 110.28 175.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 39.7 t80 -56.94 -57.8 10.92 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 118.537 0.608 . . . . 0.0 110.111 176.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -51.66 -41.39 61.33 Favored 'General case' 0 N--CA 1.456 -0.155 0 C-N-CA 124.497 1.119 . . . . 0.0 111.128 -177.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 65.3 tttp -50.24 -32.63 17.12 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.337 1.055 . . . . 0.0 112.293 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 76.9 m-85 -113.66 -55.17 2.54 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.495 0.718 . . . . 0.0 110.643 179.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 4.6 t -59.75 -38.11 80.85 Favored 'General case' 0 C--O 1.232 0.139 0 C-N-CA 124.159 0.984 . . . . 0.0 111.247 -178.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -75.89 37.05 1.25 Allowed Glycine 0 CA--C 1.527 0.84 0 O-C-N 121.754 -0.592 . . . . 0.0 113.788 -173.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 43.2 mttm -124.75 -20.75 4.96 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 126.636 1.975 . . . . 0.0 109.91 168.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -67.65 166.69 14.57 Favored 'General case' 0 N--CA 1.452 -0.325 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -65.23 -64.5 3.46 Favored Glycine 0 CA--C 1.528 0.844 0 N-CA-C 108.988 -1.645 . . . . 0.0 108.988 171.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 56.3 t0 -79.69 83.99 5.58 Favored 'General case' 0 N--CA 1.453 -0.278 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 172.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 56.5 mttp -60.27 -13.13 11.07 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 124.684 1.194 . . . . 0.0 113.803 -175.209 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 16.8 t-160 -75.65 -14.62 60.37 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 124.164 0.986 . . . . 0.0 110.343 174.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 35.9 p -122.34 153.09 39.45 Favored 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 124.723 1.209 . . . . 0.0 112.609 -179.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -155.12 -174.68 5.08 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.672 1.589 . . . . 0.0 107.919 170.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 9.1 t -147.02 -167.47 2.78 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 120.155 1.343 . . . . 0.0 112.63 -177.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -39.96 -53.87 2.28 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 127.725 2.41 . . . . 0.0 113.474 -169.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -56.87 -50.57 72.09 Favored 'General case' 0 N--CA 1.451 -0.425 0 C-N-CA 123.015 0.526 . . . . 0.0 110.754 -179.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 19.4 mp0 -65.48 -38.1 88.78 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 109.878 -0.416 . . . . 0.0 109.878 -177.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 31.6 mt -66.45 -51.26 58.75 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 118.214 0.461 . . . . 0.0 111.268 179.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 68.2 mttm -54.91 -48.96 72.38 Favored 'General case' 0 N--CA 1.456 -0.175 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 176.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 52.4 mt-10 -52.61 -60.55 3.11 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-O 119.062 -0.494 . . . . 0.0 111.019 173.164 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 9.1 mt -43.04 -64.19 0.67 Allowed 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 124.466 1.106 . . . . 0.0 110.494 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 18.3 tt -63.22 -51.09 75.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 C-N-CA 119.677 -0.809 . . . . 0.0 110.491 -174.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -67.91 -33.51 74.84 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.405 -0.809 . . . . 0.0 112.549 -171.267 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.43 -68.16 0.67 Allowed 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 108.269 -1.012 . . . . 0.0 108.269 174.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 60.8 mm-40 -64.25 -44.38 91.96 Favored 'General case' 0 N--CA 1.453 -0.291 0 O-C-N 122.158 -0.339 . . . . 0.0 110.667 -168.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 26.3 mt -100.73 51.06 0.87 Allowed 'General case' 0 N--CA 1.456 -0.144 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 172.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 7.6 t -54.42 -30.28 51.93 Favored 'General case' 0 CA--C 1.539 0.531 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 167.349 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 8.3 tt 41.48 44.72 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 127.161 2.184 . . . . 0.0 113.855 166.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 75.59 -59.58 2.91 Favored Glycine 0 CA--C 1.529 0.953 0 N-CA-C 110.094 -1.202 . . . . 0.0 110.094 -172.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 43.0 p -157.74 -89.83 0.03 OUTLIER 'General case' 0 N--CA 1.455 -0.191 0 CA-C-N 117.708 0.754 . . . . 0.0 111.981 169.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt -135.99 72.09 1.43 Allowed 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 -170.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 14.7 tp -58.42 120.41 8.72 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 115.717 -0.674 . . . . 0.0 112.072 -174.058 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 61.86 -101.42 0.11 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 126.449 1.9 . . . . 0.0 110.812 170.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 17.3 m-20 -147.3 -42.24 0.18 Allowed 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 124.916 1.287 . . . . 0.0 109.946 -174.463 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -33.55 -60.83 0.35 Allowed 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 125.87 1.668 . . . . 0.0 114.142 -178.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 62.8 tt0 -58.91 -41.39 87.14 Favored 'General case' 0 CA--C 1.528 0.121 0 CA-C-O 120.959 0.409 . . . . 0.0 110.852 -178.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 53' ' ' ILE . . . . . 0.516 ' H ' ' CD1' ' B' ' 53' ' ' ILE . 0.8 OUTLIER -64.59 -53.23 44.91 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.644 0 N-CA-C 106.665 -1.606 . . . . 0.0 106.665 -175.363 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 92.2 t -54.9 -45.58 75.62 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.278 0 C-N-CA 124.168 0.987 . . . . 0.0 110.082 177.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -55.75 -53.17 59.88 Favored 'General case' 0 CA--C 1.528 0.106 0 CA-C-N 118.538 0.608 . . . . 0.0 110.876 174.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 60.3 mt -55.85 -39.86 72.04 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 118.97 -0.538 . . . . 0.0 111.153 179.216 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 26.4 mmt -65.78 -65.6 0.66 Allowed 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 118.859 0.754 . . . . 0.0 109.186 174.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -39.3 -45.93 1.49 Allowed 'General case' 0 N--CA 1.461 0.124 0 C-N-CA 127.393 2.277 . . . . 0.0 111.892 -178.315 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -38.95 -48.3 1.57 Allowed 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 125.127 1.371 . . . . 0.0 112.227 178.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.2 pp -60.04 -39.89 87.52 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-O 119.641 -0.218 . . . . 0.0 110.827 -175.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -80.26 -42.81 22.47 Favored 'General case' 0 N--CA 1.457 -0.118 0 C-N-CA 123.005 0.522 . . . . 0.0 110.506 -178.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 54.7 ttm-85 -53.65 -45.73 70.32 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.328 0.651 . . . . 0.0 110.037 177.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 14.5 m-80 -80.7 -61.69 1.89 Allowed 'General case' 0 N--CA 1.456 -0.146 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 178.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 36.5 ttmt 58.21 -82.92 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 125.194 1.398 . . . . 0.0 110.37 -172.367 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -142.2 36.03 1.53 Allowed 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.526 1.13 . . . . 0.0 109.678 173.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 -136.45 146.12 45.99 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 125.007 1.323 . . . . 0.0 108.398 179.183 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 26.6 mp0 -70.66 166.0 21.7 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 124.148 0.979 . . . . 0.0 109.548 168.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 15.3 m -115.97 153.05 17.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 N-CA-C 106.106 -1.813 . . . . 0.0 106.106 167.369 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -96.82 174.83 6.6 Favored 'General case' 0 N--CA 1.457 -0.117 0 C-N-CA 123.085 0.554 . . . . 0.0 110.728 174.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -39.9 -60.23 1.05 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.065 0.946 . . . . 0.0 112.54 171.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 61.4 tp60 -60.48 -39.28 87.09 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 119.827 1.194 . . . . 0.0 111.835 -176.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 50.6 mm-40 -62.84 -41.37 99.32 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 121.322 -0.861 . . . . 0.0 111.339 174.141 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -56.7 -48.88 76.7 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.44 -0.787 . . . . 0.0 109.718 172.434 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 26.2 mm -59.42 -34.39 54.27 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 C-N-CA 123.725 0.81 . . . . 0.0 110.552 176.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 74.5 m -67.01 -41.91 85.88 Favored 'General case' 0 C--O 1.227 -0.121 0 O-C-N 121.479 -0.763 . . . . 0.0 110.204 174.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -56.72 -52.04 66.48 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 123.432 0.693 . . . . 0.0 109.225 174.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 44.0 mt -58.83 -44.64 90.96 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 122.246 -0.284 . . . . 0.0 111.59 175.042 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -59.5 -46.13 94.45 Favored Glycine 0 CA--C 1.526 0.771 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 -179.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.09 -48.96 77.86 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 123.395 0.678 . . . . 0.0 109.804 176.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -50.69 -58.5 5.73 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-O 122.176 0.988 . . . . 0.0 109.733 176.201 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -48.69 -55.63 10.81 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 125.368 1.467 . . . . 0.0 110.742 178.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 19.7 ttp -66.58 -39.63 88.54 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.458 0.703 . . . . 0.0 112.087 -175.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 63.6 mt -65.49 -43.99 94.25 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.287 0 CA-C-O 118.02 -0.99 . . . . 0.0 110.079 -177.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.463 0.9 OUTLIER -78.75 -40.06 34.45 Favored 'General case' 0 C--N 1.347 0.459 0 C-N-CA 118.363 -1.335 . . . . 0.0 113.349 175.132 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 42.0 m-80 -80.09 66.84 5.71 Favored 'General case' 0 N--CA 1.466 0.335 0 O-C-N 120.853 -1.154 . . . . 0.0 108.732 170.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -38.06 -42.65 0.67 Allowed 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.739 1.616 . . . . 0.0 113.328 -177.456 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -32.34 -55.07 0.33 Allowed 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.25 1.82 . . . . 0.0 112.854 170.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 89.2 mt -62.23 -15.21 45.43 Favored 'General case' 0 C--O 1.222 -0.368 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 -173.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -65.61 -29.9 70.55 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.759 1.163 . . . . 0.0 111.195 174.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.202 0 CA-C-O 116.886 -2.064 . . . . 0.0 111.66 -174.034 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 45.3 ttp . . . . . 0 N--CA 1.477 0.877 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -67.05 81.25 0.12 Allowed 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 124.434 1.094 . . . . 0.0 110.907 -177.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.08 168.18 1.68 Allowed Pre-proline 0 CA--C 1.538 0.503 0 C-N-CA 126.598 1.959 . . . . 0.0 112.246 -178.384 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -49.05 -51.54 10.4 Favored 'Trans proline' 0 N--CA 1.458 -0.611 0 C-N-CA 123.297 2.665 . . . . 0.0 112.491 174.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.423 HD23 ' HA ' ' A' ' 5' ' ' LEU . 5.8 mt -58.26 -49.18 78.02 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 119.436 -0.316 . . . . 0.0 110.705 176.597 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -54.99 -47.76 74.21 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 109.926 -0.398 . . . . 0.0 109.926 -177.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 16.0 tt0 -59.72 -51.66 68.84 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.884 0.874 . . . . 0.0 110.757 177.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.33 -46.68 85.52 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.464 0.706 . . . . 0.0 111.725 -175.783 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 75.2 mt -54.21 -53.19 31.19 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 N-CA-C 107.958 -1.126 . . . . 0.0 107.958 170.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -45.6 -47.64 12.6 Favored Glycine 0 CA--C 1.529 0.92 0 C-N-CA 124.742 1.163 . . . . 0.0 112.087 175.07 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 mt -56.62 -54.3 47.63 Favored 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 123.785 0.834 . . . . 0.0 111.007 174.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.4 mp -60.03 -44.25 94.77 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.067 0.849 . . . . 0.0 111.743 -179.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 67.7 mt -56.18 -55.67 17.35 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.194 0 C-N-CA 123.238 0.615 . . . . 0.0 109.733 173.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -52.77 -50.73 48.54 Favored Glycine 0 CA--C 1.521 0.417 0 N-CA-C 110.03 -1.228 . . . . 0.0 110.03 -177.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 5.7 mm -55.0 -48.44 75.74 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.259 0 C-N-CA 123.03 0.532 . . . . 0.0 110.443 176.054 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -55.16 -56.15 23.2 Favored 'General case' 0 CA--C 1.529 0.135 0 CA-C-N 118.668 0.667 . . . . 0.0 110.245 177.413 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -64.28 -31.96 73.37 Favored 'General case' 0 N--CA 1.451 -0.4 0 C-N-CA 123.19 0.596 . . . . 0.0 111.5 -172.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 41.3 ttmt -49.77 -43.84 48.48 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.544 1.138 . . . . 0.0 110.828 176.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 94.5 m-85 -96.12 -56.05 2.77 Favored 'General case' 0 CA--C 1.529 0.138 0 N-CA-C 109.624 -0.509 . . . . 0.0 109.624 179.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 1.8 m -56.19 -31.58 63.57 Favored 'General case' 0 C--O 1.224 -0.267 0 N-CA-C 112.148 0.425 . . . . 0.0 112.148 -175.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -51.17 -43.6 50.71 Favored Glycine 0 CA--C 1.527 0.829 0 O-C-N 121.667 -0.646 . . . . 0.0 112.36 175.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 15.8 pttm -86.36 53.23 2.73 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 118.042 0.921 . . . . 0.0 111.306 -174.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -165.0 154.78 13.26 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 126.014 1.726 . . . . 0.0 106.784 169.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -59.75 -52.19 54.48 Favored Glycine 0 CA--C 1.527 0.825 0 N-CA-C 111.292 -0.723 . . . . 0.0 111.292 -173.138 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 11.8 p-10 -79.51 54.1 1.69 Allowed 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.18 0.992 . . . . 0.0 110.665 -177.238 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -61.67 -9.8 7.04 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 115.699 1.74 . . . . 0.0 115.699 -169.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 16.5 m80 -78.53 -10.87 59.89 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.791 0.836 . . . . 0.0 110.578 175.315 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.4 p -138.89 164.51 29.48 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 127.059 2.144 . . . . 0.0 109.318 -174.041 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -161.61 163.2 30.12 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 123.829 0.852 . . . . 0.0 108.73 168.77 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 10.6 t -116.96 -169.64 1.68 Allowed 'General case' 0 CA--C 1.541 0.623 0 CA-C-N 119.229 0.922 . . . . 0.0 112.639 -174.063 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 51.1 mtpt -38.61 -65.49 0.35 Allowed 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 128.942 2.897 . . . . 0.0 113.252 -171.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 30.1 tttm -56.14 -43.54 78.36 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.386 0.674 . . . . 0.0 110.742 -174.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -66.41 -39.44 88.99 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 123.697 0.799 . . . . 0.0 110.387 -179.506 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 45.8 mt -63.1 -50.65 69.66 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 118.123 0.42 . . . . 0.0 110.822 174.394 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 36.3 mttp -53.42 -49.26 67.69 Favored 'General case' 0 C--O 1.233 0.185 0 C-N-CA 123.584 0.754 . . . . 0.0 110.061 176.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 53.2 tt0 -51.56 -69.56 0.11 Allowed 'General case' 0 C--O 1.223 -0.335 0 CA-C-O 118.308 -0.853 . . . . 0.0 109.196 171.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.6 mt -35.26 -63.47 0.33 Allowed 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 124.126 0.971 . . . . 0.0 112.476 178.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 14.7 tt -63.85 -45.27 97.54 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-O 119.118 -0.468 . . . . 0.0 110.579 -171.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.0 tt0 -70.42 -44.75 67.28 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 118.856 0.753 . . . . 0.0 111.904 -176.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 10.7 mmpt? -54.85 -58.35 7.94 Favored 'General case' 0 N--CA 1.458 -0.069 0 C-N-CA 124.236 1.015 . . . . 0.0 109.103 175.842 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -79.56 -66.66 0.84 Allowed 'General case' 0 N--CA 1.449 -0.503 0 CA-C-N 115.915 -0.584 . . . . 0.0 109.715 -171.126 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 95.9 mt -87.99 56.32 3.82 Favored 'General case' 0 N--CA 1.453 -0.31 0 O-C-N 121.615 -0.678 . . . . 0.0 109.916 -175.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.8 t -58.03 -33.34 68.87 Favored 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 168.191 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . 0.289 5.7 tt 43.37 68.47 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.423 0 C-N-CA 127.414 2.286 . . . . 0.0 112.224 168.32 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.15 -68.32 1.71 Allowed Glycine 0 CA--C 1.525 0.675 0 C-N-CA 125.306 1.431 . . . . 0.0 110.27 -179.14 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 30.9 t -173.64 55.89 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 125.925 1.69 . . . . 0.0 106.466 176.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 45.3 mttm 56.81 54.56 7.05 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.563 0.745 . . . . 0.0 110.88 -170.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 3.7 pp -66.57 133.45 50.35 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.146 -0.971 . . . . 0.0 110.361 174.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 5.2 tm0? 74.87 133.81 0.05 Allowed 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 126.428 1.891 . . . . 0.0 110.968 178.044 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -47.0 -33.54 4.79 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 125.294 1.437 . . . . 0.0 114.552 -172.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -38.64 -56.2 1.35 Allowed 'General case' 0 N--CA 1.454 -0.252 0 C-N-CA 125.442 1.497 . . . . 0.0 113.737 -173.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -63.44 -38.93 93.04 Favored 'General case' 0 N--CA 1.461 0.106 0 CA-C-O 121.267 0.556 . . . . 0.0 110.709 -174.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.656 HD12 ' H ' ' A' ' 53' ' ' ILE . 3.0 mp -68.65 -49.47 64.42 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.705 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 -175.484 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 71.6 t -53.5 -47.39 59.6 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.285 0 C-N-CA 123.342 0.657 . . . . 0.0 110.172 173.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.54 -52.63 63.06 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.73 0.695 . . . . 0.0 110.607 176.212 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 36.1 mt -55.27 -40.47 71.03 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 123.266 0.626 . . . . 0.0 111.547 -178.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.24 -61.49 1.77 Allowed 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 118.563 0.62 . . . . 0.0 109.645 174.491 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 29.7 t70 -46.61 -34.0 4.63 Favored 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 126.5 1.92 . . . . 0.0 112.269 -176.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -38.12 -50.39 1.38 Allowed 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 125.302 1.441 . . . . 0.0 111.43 173.212 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -53.03 -60.53 3.17 Favored 'General case' 0 C--O 1.233 0.198 0 C-N-CA 122.81 0.444 . . . . 0.0 109.872 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -63.34 -40.28 96.85 Favored 'General case' 0 N--CA 1.454 -0.265 0 C-N-CA 123.569 0.747 . . . . 0.0 111.467 -174.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -79.4 -30.2 42.32 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 119.485 -0.293 . . . . 0.0 111.761 -173.642 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 4.1 m-80 -77.32 -50.17 13.41 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 118.512 0.596 . . . . 0.0 109.996 173.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 82.2 mttt 55.37 41.99 30.56 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 -167.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 31.0 m-20 68.57 -36.83 0.33 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.443 1.897 . . . . 0.0 113.806 -174.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -50.84 133.78 26.1 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.617 0.644 . . . . 0.0 109.928 172.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.5 pm0 -59.81 154.74 17.68 Favored 'General case' 0 N--CA 1.448 -0.539 0 C-N-CA 123.341 0.656 . . . . 0.0 111.312 171.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 20.5 m -107.69 149.1 11.31 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 C-N-CA 126.034 1.734 . . . . 0.0 108.303 174.349 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -87.68 168.93 12.56 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.335 0.654 . . . . 0.0 111.283 175.214 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 73.2 t80 -33.59 -63.0 0.27 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 124.688 1.195 . . . . 0.0 112.963 172.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 45.2 tp60 -62.49 -31.46 72.22 Favored 'General case' 0 CA--C 1.533 0.292 0 O-C-N 120.753 -1.217 . . . . 0.0 111.839 -174.186 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -71.8 -37.74 70.36 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.261 -0.899 . . . . 0.0 110.199 176.2 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -56.67 -49.86 73.81 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 169.666 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 26.9 mm -56.59 -41.43 73.5 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 N-CA-C 110.019 -0.363 . . . . 0.0 110.019 175.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 60.1 m -59.22 -41.7 89.26 Favored 'General case' 0 C--O 1.225 -0.196 0 CA-C-N 118.821 0.737 . . . . 0.0 110.489 177.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -54.46 -54.62 38.46 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 122.027 -0.421 . . . . 0.0 109.885 174.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 62.4 mt -61.12 -40.7 94.78 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.95 -44.48 67.66 Favored Glycine 0 CA--C 1.525 0.674 0 N-CA-C 110.386 -1.086 . . . . 0.0 110.386 -176.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.02 -44.3 93.0 Favored 'General case' 0 N--CA 1.453 -0.278 0 CA-C-N 117.942 0.871 . . . . 0.0 110.302 175.387 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 14.4 tp -50.94 -57.1 9.41 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 121.278 0.561 . . . . 0.0 109.659 173.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.36 -47.32 66.21 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.135 -0.939 . . . . 0.0 110.312 178.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 37.2 ttm -58.49 -46.64 86.25 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 123.963 0.905 . . . . 0.0 110.798 -179.105 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 63.6 mt -63.51 -62.99 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.34 0.162 0 CA-C-O 118.554 -0.736 . . . . 0.0 109.886 176.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.452 0.2 OUTLIER -68.16 -34.74 76.88 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 118.025 -1.47 . . . . 0.0 112.731 -169.868 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 26.2 m-80 -83.91 66.84 9.34 Favored 'General case' 0 N--CA 1.462 0.149 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 167.628 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 82.9 mt-10 -41.78 -39.31 1.7 Allowed 'General case' 0 N--CA 1.463 0.209 0 C-N-CA 125.904 1.681 . . . . 0.0 112.028 -173.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.17 -50.94 0.31 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.848 1.659 . . . . 0.0 113.419 171.519 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 59.5 mt -61.27 -18.62 59.35 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 123.926 0.89 . . . . 0.0 113.32 -174.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -67.36 -16.78 64.45 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 118.962 0.801 . . . . 0.0 112.038 172.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.258 0 CA-C-O 116.176 -2.458 . . . . 0.0 112.23 -179.468 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 12.8 tpt . . . . . 0 N--CA 1.474 0.738 0 N-CA-C 110.334 -0.247 . . . . 0.0 110.334 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -78.02 70.49 4.4 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 176.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 3.8 m -55.66 161.5 3.16 Favored Pre-proline 0 CA--C 1.54 0.559 0 C-N-CA 123.211 0.605 . . . . 0.0 110.797 174.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_exo -44.26 -49.64 8.58 Favored 'Trans proline' 0 N--CA 1.458 -0.564 0 C-N-CA 123.615 2.877 . . . . 0.0 113.285 178.785 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 6.1 mt -53.99 -47.82 71.02 Favored 'General case' 0 C--O 1.223 -0.301 0 CA-C-O 119.643 -0.218 . . . . 0.0 111.466 174.158 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -64.93 -42.29 94.8 Favored 'General case' 0 N--CA 1.453 -0.3 0 N-CA-C 109.8 -0.445 . . . . 0.0 109.8 -174.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 tp60 -61.46 -46.69 89.01 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 122.179 0.192 . . . . 0.0 110.682 175.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.84 -46.88 83.06 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.411 0.685 . . . . 0.0 111.165 -178.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 57.8 mt -52.54 -51.99 29.95 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 C-N-CA 124.177 0.991 . . . . 0.0 108.448 169.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.68 -48.46 23.17 Favored Glycine 0 CA--C 1.528 0.874 0 C-N-CA 124.971 1.272 . . . . 0.0 111.654 175.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 mt -56.03 -54.51 44.03 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 117.492 0.646 . . . . 0.0 111.027 174.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 mp -57.94 -44.81 87.16 Favored 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.053 0.842 . . . . 0.0 111.666 -179.48 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 96.2 mt -56.32 -54.01 33.12 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 C-N-CA 123.171 0.588 . . . . 0.0 110.263 173.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.27 -50.19 57.01 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 110.293 -1.123 . . . . 0.0 110.293 -178.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 9.1 mm -53.85 -48.52 62.12 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.315 0 C-N-CA 123.684 0.794 . . . . 0.0 110.549 176.019 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -55.47 -62.28 1.78 Allowed 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 121.326 0.584 . . . . 0.0 109.686 176.571 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.7 t-80 -52.7 -41.16 63.64 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 124.312 1.045 . . . . 0.0 111.427 -174.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 86.3 tttt -47.58 -39.96 17.97 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.713 1.205 . . . . 0.0 111.43 178.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -96.89 -62.48 1.25 Allowed 'General case' 0 C--O 1.233 0.199 0 N-CA-C 109.044 -0.725 . . . . 0.0 109.044 178.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 3.4 m -49.2 -44.09 42.9 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 124.135 0.974 . . . . 0.0 111.975 -173.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -44.54 -38.16 5.26 Favored Glycine 0 C--N 1.339 0.726 0 C-N-CA 124.972 1.272 . . . . 0.0 113.068 -177.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -72.71 -23.74 60.9 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 112.595 0.591 . . . . 0.0 112.595 -170.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -79.58 6.76 9.71 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -168.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 79.61 -51.75 4.04 Favored Glycine 0 CA--C 1.528 0.881 0 O-C-N 120.589 -1.319 . . . . 0.0 110.102 -176.488 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -78.29 59.46 2.31 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 107.694 -1.225 . . . . 0.0 107.694 168.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 65.8 mttt -41.58 -37.89 1.23 Allowed 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 127.378 2.271 . . . . 0.0 115.738 -166.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 45.2 m80 -99.47 17.27 20.73 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 112.756 0.65 . . . . 0.0 112.756 -173.218 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -138.63 160.22 40.14 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 126.039 1.735 . . . . 0.0 107.412 176.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.53 176.87 11.12 Favored 'General case' 0 CA--C 1.529 0.154 0 CA-C-O 118.998 -0.525 . . . . 0.0 110.938 176.369 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 39.1 p -125.71 174.0 8.62 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-N 118.701 0.682 . . . . 0.0 112.491 -174.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 11.3 ptpt -26.39 -56.65 0.08 Allowed 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 127.889 2.476 . . . . 0.0 113.981 170.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -53.78 -52.58 59.79 Favored 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 123.136 0.574 . . . . 0.0 110.551 -178.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 26.0 mp0 -67.8 -37.2 81.7 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-O 118.693 -0.67 . . . . 0.0 110.391 -178.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 62.3 mt -62.11 -51.96 65.8 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.266 0.939 . . . . 0.0 111.108 178.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -61.93 -42.13 98.75 Favored 'General case' 0 N--CA 1.455 -0.219 0 C-N-CA 122.987 0.515 . . . . 0.0 110.002 -179.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 58.9 mt-10 -54.87 -67.01 0.3 Allowed 'General case' 0 C--O 1.222 -0.353 0 CA-C-O 119.302 -0.38 . . . . 0.0 110.299 169.731 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 12.7 mt -37.61 -63.38 0.46 Allowed 'General case' 0 CA--C 1.52 -0.184 0 C-N-CA 125.98 1.712 . . . . 0.0 111.224 -179.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 13.6 tt -57.26 -54.38 31.29 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 C-N-CA 120.487 -0.485 . . . . 0.0 110.158 -174.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 -73.7 -31.32 63.35 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 112.994 0.738 . . . . 0.0 112.994 -170.417 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.9 -56.98 4.2 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 108.575 -0.898 . . . . 0.0 108.575 176.336 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 68.9 mm-40 -77.06 -26.65 53.8 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-O 117.911 -1.042 . . . . 0.0 112.628 -168.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 95.5 mt -98.14 96.15 7.91 Favored 'General case' 0 C--N 1.339 0.11 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 167.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 55.5 p -76.27 42.56 0.27 Allowed 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.884 0.874 . . . . 0.0 110.862 -179.763 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 60.2 mt -87.66 72.77 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.542 0 N-CA-C 106.47 -1.678 . . . . 0.0 106.47 -177.307 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -51.07 -33.95 30.62 Favored Glycine 0 CA--C 1.532 1.105 0 CA-C-N 115.858 -0.61 . . . . 0.0 112.208 178.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 3.0 p -67.58 -20.48 65.38 Favored 'General case' 0 N--CA 1.45 -0.454 0 C-N-CA 124.835 1.254 . . . . 0.0 113.365 178.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 33.1 mmtp 47.93 60.31 3.65 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.413 1.085 . . . . 0.0 110.427 -173.393 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 97.4 mt -29.41 -56.58 0.15 Allowed 'General case' 0 N--CA 1.466 0.366 0 C-N-CA 127.102 2.161 . . . . 0.0 115.466 -169.059 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -153.27 157.49 40.23 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 106.748 -1.575 . . . . 0.0 106.748 -172.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -33.54 -43.09 0.12 Allowed 'General case' 0 C--O 1.225 -0.229 0 C-N-CA 128.369 2.668 . . . . 0.0 114.111 -172.204 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -28.7 -60.13 0.13 Allowed 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 126.453 1.901 . . . . 0.0 113.561 -178.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 47.1 tt0 -67.65 -39.81 84.56 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-O 120.889 0.376 . . . . 0.0 110.603 -172.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 53' ' ' ILE . . . . . 0.501 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.1 mp -62.05 -54.1 38.91 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.363 0 N-CA-C 106.931 -1.507 . . . . 0.0 106.931 179.213 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 70.9 t -58.71 -40.99 81.14 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 C-N-CA 124.452 1.101 . . . . 0.0 110.116 -177.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -58.19 -54.67 44.35 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 118.916 0.78 . . . . 0.0 110.307 172.198 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 36.7 mt -51.87 -41.87 62.21 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 119.231 -0.414 . . . . 0.0 111.606 178.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 24.0 mmt -69.56 -64.56 0.86 Allowed 'General case' 0 CA--C 1.536 0.426 0 CA-C-O 121.533 0.683 . . . . 0.0 109.988 177.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.65 -25.5 62.82 Favored 'General case' 0 N--CA 1.457 -0.088 0 C-N-CA 124.791 1.236 . . . . 0.0 112.293 -169.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -41.29 -50.09 3.69 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 124.273 1.029 . . . . 0.0 111.166 168.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 78.4 mt -59.08 -53.28 60.15 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 -174.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -60.7 -44.03 97.07 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 124.582 1.153 . . . . 0.0 110.948 -179.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 29.4 ttm105 -59.05 -52.75 64.41 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 123.407 0.683 . . . . 0.0 110.108 178.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -76.14 -63.07 1.4 Allowed 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 116.663 -0.244 . . . . 0.0 110.372 -171.778 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 79.6 mttt 62.4 -75.31 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.261 1.425 . . . . 0.0 109.905 -167.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -143.21 8.37 1.61 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 125.435 1.494 . . . . 0.0 111.359 175.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 26.0 mt-30 -94.03 135.53 35.28 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.629 1.172 . . . . 0.0 108.43 -175.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 16.6 mt-10 -81.05 150.47 28.81 Favored 'General case' 0 CA--C 1.531 0.213 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 168.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 15.2 m -106.39 150.96 8.57 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 C-N-CA 124.697 1.199 . . . . 0.0 108.807 174.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -90.82 174.14 7.62 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 123.861 0.864 . . . . 0.0 110.826 173.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 58.8 t80 -39.06 -62.11 0.68 Allowed 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.019 1.328 . . . . 0.0 112.883 173.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 39.0 tp60 -61.84 -35.33 77.94 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 119.603 1.092 . . . . 0.0 111.605 -173.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -66.21 -43.42 86.77 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.667 -0.646 . . . . 0.0 110.139 176.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -54.67 -48.33 72.5 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 121.867 -0.52 . . . . 0.0 109.896 171.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 25.5 mm -58.55 -37.8 66.95 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 O-C-N 121.889 -0.507 . . . . 0.0 110.355 175.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 37.5 m -62.99 -42.86 99.96 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 121.521 -0.737 . . . . 0.0 110.203 175.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 47.2 t80 -56.14 -55.07 37.54 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 122.958 0.503 . . . . 0.0 110.017 176.046 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 39.6 mt -60.64 -44.28 96.58 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 122.188 -0.32 . . . . 0.0 111.861 177.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.56 -39.64 95.64 Favored Glycine 0 CA--C 1.527 0.803 0 N-CA-C 111.059 -0.816 . . . . 0.0 111.059 -175.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.32 -50.53 72.56 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 117.541 0.67 . . . . 0.0 109.425 173.118 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -49.39 -54.69 16.07 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 121.445 0.64 . . . . 0.0 109.894 174.658 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.08 -56.85 11.8 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 124.487 1.115 . . . . 0.0 110.716 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 11.4 ttp -60.74 -45.55 93.85 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.656 0.782 . . . . 0.0 111.315 -177.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 63.3 mt -61.97 -47.75 91.74 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 CA-C-O 117.916 -1.04 . . . . 0.0 110.216 -175.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.453 0.0 OUTLIER -83.2 -31.58 27.0 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 179.89 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 32.0 m-80 -80.11 77.55 6.81 Favored 'General case' 0 N--CA 1.462 0.126 0 O-C-N 120.715 -1.241 . . . . 0.0 108.749 173.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 55.0 mm-40 -36.71 -43.29 0.41 Allowed 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 126.024 1.729 . . . . 0.0 112.466 178.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -41.46 -41.19 1.99 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 126.185 1.794 . . . . 0.0 113.734 176.419 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 90.5 mt -75.35 -16.52 60.39 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -177.278 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 9.8 mtmp? -102.0 -44.66 5.41 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.295 1.038 . . . . 0.0 110.689 179.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.158 0 CA-C-O 117.424 -1.764 . . . . 0.0 110.329 -177.223 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 68.5 mtm . . . . . 0 N--CA 1.474 0.761 0 CA-C-O 120.407 0.146 . . . . 0.0 110.976 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -67.66 77.7 0.19 Allowed 'General case' 0 CA--C 1.53 0.196 0 CA-C-O 121.894 0.854 . . . . 0.0 109.706 176.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 13.6 m -60.01 160.87 14.2 Favored Pre-proline 0 CA--C 1.543 0.7 0 C-N-CA 125.93 1.692 . . . . 0.0 109.717 -177.659 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo -48.61 -49.41 14.79 Favored 'Trans proline' 0 C--N 1.346 0.441 0 C-N-CA 122.977 2.451 . . . . 0.0 112.92 -176.779 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 4.6 mt -58.83 -41.25 86.45 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 173.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -63.04 -40.79 98.77 Favored 'General case' 0 C--O 1.225 -0.201 0 CA-C-N 118.979 0.809 . . . . 0.0 109.389 -178.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -60.24 -51.87 67.72 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 122.753 0.421 . . . . 0.0 110.427 174.487 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.56 -46.87 88.59 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-O 121.563 0.697 . . . . 0.0 111.639 -177.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 60.6 mt -55.23 -50.8 61.6 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.207 0 N-CA-C 108.666 -0.864 . . . . 0.0 108.666 171.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -48.06 -46.96 26.79 Favored Glycine 0 CA--C 1.526 0.747 0 C-N-CA 125.157 1.361 . . . . 0.0 111.688 176.029 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.6 mt -54.85 -55.93 24.95 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 123.775 0.83 . . . . 0.0 110.916 173.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 11.0 mp -60.35 -43.87 96.08 Favored 'General case' 0 CA--C 1.54 0.565 0 O-C-N 121.546 -0.721 . . . . 0.0 111.914 -179.025 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 96.1 mt -55.34 -56.16 13.04 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.206 0 C-N-CA 123.226 0.611 . . . . 0.0 109.592 173.431 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -52.77 -49.72 52.78 Favored Glycine 0 CA--C 1.522 0.483 0 N-CA-C 110.356 -1.098 . . . . 0.0 110.356 -177.271 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 7.9 mm -53.4 -46.94 59.05 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 C-N-CA 122.694 0.398 . . . . 0.0 110.84 176.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 29.3 t80 -58.87 -60.35 3.98 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 121.939 0.876 . . . . 0.0 109.8 176.342 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.1 t-80 -55.41 -34.14 64.15 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 125.468 1.507 . . . . 0.0 111.871 -172.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 65.3 tttp -46.68 -36.69 7.37 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.586 1.154 . . . . 0.0 111.567 174.425 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 -104.88 -62.61 1.32 Allowed 'General case' 0 C--O 1.235 0.303 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 176.002 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.5 m -51.4 -34.77 36.09 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 124.74 1.216 . . . . 0.0 112.705 -171.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -43.67 -33.66 2.45 Favored Glycine 0 C--N 1.34 0.757 0 C-N-CA 124.062 0.839 . . . . 0.0 113.222 178.511 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -131.02 -37.38 1.28 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.282 0.633 . . . . 0.0 112.265 178.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -78.68 69.3 4.84 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 121.432 -0.792 . . . . 0.0 109.984 -176.715 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 121.63 -103.15 0.85 Allowed Glycine 0 CA--C 1.523 0.566 0 N-CA-C 107.667 -2.173 . . . . 0.0 107.667 -176.451 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -155.6 152.57 28.91 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 173.258 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.42 -20.71 1.92 Allowed 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 -178.592 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 22.6 t-160 -89.4 -29.47 19.05 Favored 'General case' 0 CA--C 1.536 0.422 0 N-CA-C 113.793 1.034 . . . . 0.0 113.793 172.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 36.4 p -138.3 139.77 39.26 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 113.949 1.092 . . . . 0.0 113.949 -168.547 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -145.65 -172.84 3.98 Favored 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 124.413 1.085 . . . . 0.0 108.92 169.42 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 96.5 p -147.21 -179.86 7.13 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.813 1.188 . . . . 0.0 113.188 -170.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 54.0 mtmt -19.18 -71.3 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 128.922 2.889 . . . . 0.0 115.132 -178.287 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.1 ttpt -60.38 -44.76 95.34 Favored 'General case' 0 N--CA 1.451 -0.405 0 O-C-N 121.88 -0.512 . . . . 0.0 109.879 -172.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -59.97 -40.98 90.95 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 123.199 0.6 . . . . 0.0 110.084 177.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 38.0 mt -65.2 -49.99 67.61 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 118.121 0.419 . . . . 0.0 111.365 178.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -57.6 -51.25 70.25 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 178.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 59.1 tt0 -48.4 -57.75 5.6 Favored 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 124.988 1.315 . . . . 0.0 109.751 173.462 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 3.3 mt -46.36 -72.94 0.05 OUTLIER 'General case' 0 N--CA 1.456 -0.126 0 C-N-CA 124.306 1.043 . . . . 0.0 110.247 176.017 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 18.8 tt -55.54 -42.53 68.75 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 CA-C-N 117.787 0.267 . . . . 0.0 110.533 -169.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 16.8 tt0 -56.38 -51.37 68.58 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.83 -0.544 . . . . 0.0 111.618 174.544 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -67.29 -54.07 24.1 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 118.12 0.418 . . . . 0.0 110.596 -174.04 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -92.14 -9.12 43.61 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -169.771 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 23.1 mt -129.81 69.27 1.43 Allowed 'General case' 0 N--CA 1.456 -0.158 0 N-CA-C 107.746 -1.205 . . . . 0.0 107.746 170.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 16.6 p -66.25 80.43 0.09 Allowed 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 169.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 9.6 tp -75.65 53.76 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.578 0 C-N-CA 126.946 2.098 . . . . 0.0 112.153 -168.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 56.13 -82.73 0.01 OUTLIER Glycine 0 C--N 1.34 0.757 0 C-N-CA 126.955 2.217 . . . . 0.0 111.857 -178.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 35.3 m -154.58 46.46 0.56 Allowed 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 124.785 1.234 . . . . 0.0 108.61 174.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 8.7 mtmp? 75.63 61.55 0.05 Allowed 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 126.116 1.766 . . . . 0.0 110.118 -175.598 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 18.0 mt -47.3 -50.97 20.52 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 113.37 0.878 . . . . 0.0 113.37 -178.594 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -152.8 143.1 22.51 Favored 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 -168.351 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -36.41 -43.54 0.39 Allowed 'General case' 0 N--CA 1.465 0.298 0 C-N-CA 127.781 2.432 . . . . 0.0 115.523 -169.695 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -32.62 -62.01 0.25 Allowed 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.535 1.534 . . . . 0.0 114.563 -174.665 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -65.23 -36.0 82.79 Favored 'General case' 0 CA--C 1.528 0.132 0 CA-C-O 120.796 0.331 . . . . 0.0 111.093 -174.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.566 ' N ' HD12 ' A' ' 53' ' ' ILE . 1.3 mp -66.59 -52.75 42.55 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 N-CA-C 105.941 -1.874 . . . . 0.0 105.941 -176.267 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 86.4 t -53.38 -45.01 56.44 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 C-N-CA 124.173 0.989 . . . . 0.0 109.922 174.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.1 -50.39 73.65 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 118.92 0.782 . . . . 0.0 111.444 176.181 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 54.9 mt -56.06 -39.87 72.7 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 119.151 -0.452 . . . . 0.0 111.038 178.037 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 24.7 mmt -67.49 -60.35 2.64 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 118.808 0.731 . . . . 0.0 109.457 175.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -46.83 -40.17 13.31 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 126.89 2.076 . . . . 0.0 111.697 -176.23 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -38.78 -48.98 1.58 Allowed 'General case' 0 N--CA 1.456 -0.14 0 C-N-CA 124.908 1.283 . . . . 0.0 111.842 174.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 73.1 mt -58.45 -54.23 49.41 Favored 'General case' 0 N--CA 1.454 -0.245 0 N-CA-C 109.792 -0.448 . . . . 0.0 109.792 -176.31 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -66.01 -40.15 90.86 Favored 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 124.092 0.957 . . . . 0.0 111.275 -178.029 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 17.4 ttm180 -59.59 -48.97 79.59 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 123.895 0.878 . . . . 0.0 109.585 178.254 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -80.56 -69.74 0.58 Allowed 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 120.621 0.248 . . . . 0.0 110.578 -175.442 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 22.4 mtmm 63.9 -72.24 0.06 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 126.018 1.727 . . . . 0.0 108.152 -166.515 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -137.43 -18.62 1.26 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 126.172 1.789 . . . . 0.0 111.881 171.137 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.01 109.42 6.53 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 123.536 0.734 . . . . 0.0 110.26 -174.38 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 5.2 mp0 -53.65 125.8 19.55 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 169.21 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 11.0 m -80.37 139.79 17.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 -179.047 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -83.17 172.09 13.0 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 120.988 0.423 . . . . 0.0 111.232 176.385 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -41.61 -59.48 1.62 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.577 1.151 . . . . 0.0 111.827 173.08 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 36.0 tp60 -61.12 -38.87 87.89 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 119.11 0.868 . . . . 0.0 111.564 -175.6 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 35.6 mt-10 -60.94 -44.6 97.02 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.532 -0.73 . . . . 0.0 110.807 174.347 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -58.08 -47.62 82.65 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 121.699 -0.626 . . . . 0.0 109.961 174.115 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.7 mm -59.08 -33.51 50.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 O-C-N 121.704 -0.622 . . . . 0.0 110.174 175.315 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 41.8 m -69.24 -36.2 76.92 Favored 'General case' 0 C--O 1.224 -0.287 0 O-C-N 121.448 -0.782 . . . . 0.0 110.402 173.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -58.52 -56.88 16.4 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 173.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 33.1 mt -60.7 -45.2 95.09 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 122.451 0.3 . . . . 0.0 111.781 178.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.65 -43.97 95.64 Favored Glycine 0 CA--C 1.524 0.645 0 N-CA-C 110.742 -0.943 . . . . 0.0 110.742 -176.581 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.02 -45.48 81.36 Favored 'General case' 0 N--CA 1.451 -0.411 0 O-C-N 121.961 -0.729 . . . . 0.0 110.139 176.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -48.73 -55.71 10.66 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 123.469 0.708 . . . . 0.0 109.872 171.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -53.37 -54.8 31.4 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 124.28 1.032 . . . . 0.0 111.092 178.114 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 21.7 ttp -63.02 -36.26 82.97 Favored 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 123.995 0.918 . . . . 0.0 111.774 -176.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 83.1 mt -64.31 -60.66 2.4 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 N-CA-C 108.668 -0.864 . . . . 0.0 108.668 176.134 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.439 0.2 OUTLIER -67.79 -35.7 79.11 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 117.188 -1.805 . . . . 0.0 112.638 -173.374 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 44.6 m-80 -80.1 65.8 5.37 Favored 'General case' 0 C--O 1.233 0.212 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 169.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -35.38 -46.94 0.4 Allowed 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 126.413 1.885 . . . . 0.0 111.968 -176.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -27.64 -58.25 0.11 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.711 2.004 . . . . 0.0 113.307 171.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.7 mt -60.48 -19.5 56.9 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -172.243 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -67.68 -29.85 69.23 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 119.008 0.822 . . . . 0.0 111.488 174.174 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.207 0 CA-C-O 117.491 -1.727 . . . . 0.0 112.845 -169.703 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 5.0 ppp? . . . . . 0 N--CA 1.475 0.794 0 CA-C-O 119.862 -0.113 . . . . 0.0 110.806 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -110.35 99.34 8.38 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 123.777 0.831 . . . . 0.0 108.952 178.473 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 46.1 p -69.66 166.7 28.85 Favored Pre-proline 0 N--CA 1.452 -0.366 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 171.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_exo -49.37 -44.95 32.43 Favored 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 122.438 2.092 . . . . 0.0 110.986 168.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.431 HD23 ' HA ' ' B' ' 5' ' ' LEU . 2.1 mt -56.28 -58.36 8.3 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-O 118.621 -0.704 . . . . 0.0 112.475 170.678 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -56.61 -38.8 72.56 Favored 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 119.162 0.892 . . . . 0.0 110.481 -174.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 19.3 tt0 -61.4 -51.47 68.61 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.952 0.901 . . . . 0.0 111.194 173.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.73 -46.2 90.66 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.631 0.729 . . . . 0.0 111.362 -178.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 82.4 mt -53.03 -52.1 32.31 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 C-N-CA 124.597 1.159 . . . . 0.0 108.048 169.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.53 -47.66 22.93 Favored Glycine 0 CA--C 1.527 0.818 0 C-N-CA 124.94 1.257 . . . . 0.0 111.903 174.211 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.6 mt -54.48 -56.47 18.42 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 123.719 0.808 . . . . 0.0 110.408 173.292 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -56.79 -43.31 80.77 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 118.663 0.665 . . . . 0.0 111.69 -179.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 99.3 mt -58.42 -54.41 33.26 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 C-N-CA 123.007 0.523 . . . . 0.0 110.681 173.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.76 -49.93 67.08 Favored Glycine 0 CA--C 1.522 0.519 0 N-CA-C 110.313 -1.115 . . . . 0.0 110.313 -177.156 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 8.1 mm -51.25 -51.66 22.23 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 C-N-CA 124.182 0.993 . . . . 0.0 109.843 173.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -54.17 -56.44 18.21 Favored 'General case' 0 N--CA 1.456 -0.155 0 N-CA-C 110.172 -0.306 . . . . 0.0 110.172 177.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -58.04 -38.15 75.7 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 123.754 0.821 . . . . 0.0 111.241 -175.236 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 64.2 tttm -50.37 -42.82 53.92 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 123.824 0.849 . . . . 0.0 111.118 179.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -98.32 -30.42 12.6 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 122.781 0.432 . . . . 0.0 112.029 -178.365 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 14.2 m -69.6 -34.3 73.92 Favored 'General case' 0 C--O 1.226 -0.133 0 O-C-N 121.861 -0.524 . . . . 0.0 110.925 178.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -72.49 53.75 1.56 Allowed Glycine 0 CA--C 1.527 0.814 0 C-N-CA 124.597 1.094 . . . . 0.0 112.077 177.434 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt -147.72 -56.24 0.23 Allowed 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 124.939 1.295 . . . . 0.0 110.27 -177.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -127.28 161.41 28.65 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.254 1.021 . . . . 0.0 111.369 -168.14 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 54.91 -144.79 30.74 Favored Glycine 0 CA--C 1.529 0.938 0 C-N-CA 124.064 0.84 . . . . 0.0 111.912 175.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 3.6 t70 -78.73 132.6 37.02 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 105.369 -2.085 . . . . 0.0 105.369 168.659 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 28.0 mmtp -71.68 5.01 2.71 Favored 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 114.706 1.373 . . . . 0.0 114.706 -168.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 14.7 m80 -113.99 20.93 15.32 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.588 1.155 . . . . 0.0 110.232 168.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 53.8 p -134.06 166.97 21.49 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 125.298 1.439 . . . . 0.0 107.522 169.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -160.77 160.25 31.05 Favored 'General case' 0 CA--C 1.532 0.267 0 N-CA-C 113.155 0.798 . . . . 0.0 113.155 171.55 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -100.93 176.74 5.17 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 125.42 1.488 . . . . 0.0 113.009 -169.589 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -42.72 -52.17 5.04 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 126.533 1.933 . . . . 0.0 113.825 179.13 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -62.81 -47.63 82.62 Favored 'General case' 0 N--CA 1.448 -0.575 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 -175.22 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -59.29 -40.56 86.57 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.701 0.8 . . . . 0.0 111.187 177.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 35.5 mt -64.44 -48.1 76.58 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 118.471 0.578 . . . . 0.0 111.311 175.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 9.0 mtmp? -57.86 -43.24 85.83 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 121.951 -0.468 . . . . 0.0 110.297 175.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 55.5 mt-10 -55.28 -57.91 9.88 Favored 'General case' 0 C--O 1.224 -0.245 0 CA-C-O 119.189 -0.434 . . . . 0.0 110.553 171.076 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 10.7 mt -44.22 -59.39 2.38 Favored 'General case' 0 N--CA 1.457 -0.089 0 C-N-CA 123.898 0.879 . . . . 0.0 110.242 -179.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 16.0 tt -64.64 -51.43 67.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 C-N-CA 119.683 -0.807 . . . . 0.0 110.297 -177.47 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -64.24 -32.59 74.24 Favored 'General case' 0 CA--C 1.538 0.51 0 O-C-N 120.959 -1.088 . . . . 0.0 112.887 -172.42 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -88.11 -58.5 2.54 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.194 0.998 . . . . 0.0 109.937 177.611 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 49.7 mm-40 -82.78 -24.79 33.27 Favored 'General case' 0 CA--C 1.529 0.171 0 O-C-N 121.449 -0.782 . . . . 0.0 112.966 -168.395 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 58.4 mt -115.87 45.05 1.79 Allowed 'General case' 0 N--CA 1.46 0.065 0 C-N-CA 124.958 1.303 . . . . 0.0 108.02 169.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 1.8 t -56.21 -45.32 79.91 Favored 'General case' 0 N--CA 1.454 -0.274 0 CA-C-O 119.368 -0.349 . . . . 0.0 110.807 -173.259 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 63.5 mt 67.24 -56.69 0.26 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 C-N-CA 125.562 1.545 . . . . 0.0 113.623 169.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.98 -68.43 1.97 Allowed Glycine 0 CA--C 1.524 0.595 0 N-CA-C 109.438 -1.465 . . . . 0.0 109.438 -176.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 12.8 m -69.48 73.95 0.37 Allowed 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.314 1.046 . . . . 0.0 109.591 172.684 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 18.6 mmtm -45.99 93.29 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.105 1.762 . . . . 0.0 110.746 179.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 87.8 mt -51.42 -54.7 24.12 Favored 'General case' 0 N--CA 1.456 -0.159 0 C-N-CA 124.8 1.24 . . . . 0.0 112.114 -169.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -167.05 161.18 14.66 Favored 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 106.406 -1.702 . . . . 0.0 106.406 -172.299 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -37.03 -40.61 0.3 Allowed 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 128.024 2.53 . . . . 0.0 114.777 -171.53 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.4 -60.08 0.15 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.682 1.593 . . . . 0.0 114.45 -176.225 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 62.3 tt0 -63.55 -44.06 95.26 Favored 'General case' 0 C--O 1.233 0.204 0 C-N-CA 122.756 0.422 . . . . 0.0 110.81 -176.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 53' ' ' ILE . . . . . 0.484 ' H ' ' CD1' ' B' ' 53' ' ' ILE . 1.2 mp -59.96 -50.06 81.59 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.459 0 N-CA-C 106.461 -1.681 . . . . 0.0 106.461 -176.708 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 75.0 t -55.96 -54.62 24.84 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.535 176.528 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.41 -51.04 28.56 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 118.555 0.616 . . . . 0.0 111.764 -179.641 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 27.7 mt -52.19 -40.86 62.11 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 122.703 0.401 . . . . 0.0 112.06 -178.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -81.06 -58.48 3.05 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 123.625 0.77 . . . . 0.0 110.582 179.751 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -40.98 -42.61 1.93 Allowed 'General case' 0 N--CA 1.462 0.133 0 C-N-CA 126.484 1.914 . . . . 0.0 111.418 177.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -38.41 -51.64 1.55 Allowed 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 125.123 1.369 . . . . 0.0 112.897 174.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -58.15 -50.54 73.15 Favored 'General case' 0 CA--C 1.53 0.203 0 N-CA-C 109.68 -0.489 . . . . 0.0 109.68 -174.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -64.49 -49.04 72.92 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.683 0.393 . . . . 0.0 110.445 179.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 13.7 ttm180 -50.99 -54.2 26.49 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 124.113 0.965 . . . . 0.0 110.073 -179.154 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -68.08 -51.48 46.04 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-O 119.135 -0.46 . . . . 0.0 110.638 -179.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . 0.301 6.2 ptpp? 52.62 -74.55 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 125.933 1.693 . . . . 0.0 112.515 -169.167 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 17.4 m-20 -146.82 34.69 0.92 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 125.039 1.336 . . . . 0.0 110.042 173.384 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -123.58 137.26 54.78 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.559 1.144 . . . . 0.0 110.009 -174.167 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -87.29 117.22 25.9 Favored 'General case' 0 N--CA 1.453 -0.291 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 169.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 19.7 m -79.06 145.8 8.91 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.225 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 -177.328 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -82.77 177.7 8.54 Favored 'General case' 0 CA--C 1.528 0.133 0 C-N-CA 123.925 0.89 . . . . 0.0 111.377 177.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -48.16 -63.31 1.11 Allowed 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 123.963 0.905 . . . . 0.0 112.209 178.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 43.2 tp60 -61.99 -34.18 75.69 Favored 'General case' 0 CA--C 1.531 0.245 0 O-C-N 121.138 -0.976 . . . . 0.0 111.13 -174.03 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 61.3 mt-10 -63.24 -45.54 91.11 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 121.569 -0.707 . . . . 0.0 110.75 174.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -54.61 -49.11 71.24 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 121.645 -0.659 . . . . 0.0 109.98 170.799 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 22.4 mm -57.94 -34.47 48.7 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 O-C-N 121.689 -0.632 . . . . 0.0 110.343 176.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 33.2 m -67.9 -39.74 83.57 Favored 'General case' 0 CA--C 1.53 0.206 0 O-C-N 121.343 -0.848 . . . . 0.0 110.541 175.425 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -53.8 -55.19 28.7 Favored 'General case' 0 CA--C 1.534 0.356 0 O-C-N 121.656 -0.652 . . . . 0.0 109.63 171.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 34.9 mt -60.16 -45.32 93.46 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.791 178.707 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.0 -42.25 98.29 Favored Glycine 0 CA--C 1.524 0.623 0 N-CA-C 110.787 -0.925 . . . . 0.0 110.787 -176.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.43 -50.17 68.59 Favored 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 123.273 0.629 . . . . 0.0 110.108 175.719 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -48.14 -56.66 7.3 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 121.775 0.798 . . . . 0.0 110.136 173.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.81 -54.1 39.01 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.015 1.326 . . . . 0.0 110.695 179.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 50.1 ttm -57.32 -48.67 78.37 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 124.232 1.013 . . . . 0.0 110.619 -179.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 61.9 mt -63.36 -51.43 71.01 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 CA-C-O 117.585 -1.198 . . . . 0.0 109.653 -174.212 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.436 0.8 OUTLIER -73.58 -39.69 64.46 Favored 'General case' 0 C--N 1.347 0.482 0 C-N-CA 118.15 -1.42 . . . . 0.0 112.707 -179.561 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 38.5 m-80 -80.59 63.09 4.9 Favored 'General case' 0 N--CA 1.463 0.209 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 169.06 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -51.33 -25.22 5.58 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 124.102 0.961 . . . . 0.0 113.058 -172.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -39.55 -50.51 2.2 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.832 1.253 . . . . 0.0 111.49 167.107 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 86.1 mt -66.8 -3.37 6.63 Favored 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 124.689 1.196 . . . . 0.0 113.535 -176.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -73.55 -23.1 59.93 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 120.11 1.323 . . . . 0.0 109.732 168.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.2 0 CA-C-O 116.924 -2.042 . . . . 0.0 110.078 178.83 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.2 ptm . . . . . 0 N--CA 1.478 0.961 0 N-CA-C 113.118 0.784 . . . . 0.0 113.118 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -71.65 81.85 0.84 Allowed 'General case' 0 CA--C 1.53 0.198 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 177.393 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 70.0 p -54.4 162.93 1.44 Allowed Pre-proline 0 CA--C 1.533 0.319 0 C-N-CA 124.348 1.059 . . . . 0.0 111.21 174.03 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -47.99 -46.59 21.55 Favored 'Trans proline' 0 N--CA 1.455 -0.754 0 C-N-CA 122.356 2.038 . . . . 0.0 110.676 168.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.466 HD23 ' HA ' ' A' ' 5' ' ' LEU . 4.7 mt -55.11 -59.28 4.98 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-O 119.26 -0.4 . . . . 0.0 111.716 173.257 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -52.55 -48.14 66.32 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.13 0.423 . . . . 0.0 110.336 -176.021 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.85 -49.98 75.27 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.499 0.72 . . . . 0.0 110.258 -179.558 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.49 -45.69 91.87 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 123.949 0.9 . . . . 0.0 111.99 -177.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 84.8 mt -55.14 -50.92 59.91 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 N-CA-C 107.737 -1.209 . . . . 0.0 107.737 171.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -45.56 -49.14 11.92 Favored Glycine 0 CA--C 1.529 0.928 0 C-N-CA 124.505 1.05 . . . . 0.0 112.033 172.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.6 mt -56.88 -55.15 38.16 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 118.055 0.927 . . . . 0.0 111.303 175.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -59.85 -44.42 94.13 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 119.293 0.951 . . . . 0.0 111.505 -177.491 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 77.8 mt -56.45 -53.71 37.25 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 123.523 0.729 . . . . 0.0 109.948 173.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -53.81 -49.29 58.9 Favored Glycine 0 CA--C 1.522 0.47 0 C-N-CA 124.443 1.021 . . . . 0.0 110.572 -179.124 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 7.3 mm -57.76 -44.53 86.1 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 C-N-CA 122.986 0.514 . . . . 0.0 110.185 176.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 39.6 t80 -55.81 -54.89 39.0 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 118.797 0.726 . . . . 0.0 109.89 175.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 37.4 m-70 -64.9 -26.78 68.46 Favored 'General case' 0 CA--C 1.531 0.225 0 N-CA-C 113.48 0.918 . . . . 0.0 113.48 -177.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.2 ttmm -52.82 -26.11 13.53 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 118.694 0.679 . . . . 0.0 110.751 170.403 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -127.51 41.7 3.46 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.715 1.206 . . . . 0.0 109.118 173.174 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 31.9 m -38.27 103.18 0.03 OUTLIER 'General case' 0 C--N 1.348 0.512 0 C-N-CA 125.799 1.64 . . . . 0.0 112.408 -177.557 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -2.21 81.71 0.0 OUTLIER Glycine 0 C--N 1.34 0.775 0 C-N-CA 128.272 2.844 . . . . 0.0 114.646 177.503 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 44.2 mttp -73.68 -6.08 44.58 Favored 'General case' 0 CA--C 1.532 0.279 0 O-C-N 121.982 -0.716 . . . . 0.0 111.93 -169.226 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 3.8 mm-40 -77.41 52.28 0.94 Allowed 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.612 1.165 . . . . 0.0 109.713 176.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 70.31 -68.32 0.7 Allowed Glycine 0 CA--C 1.532 1.115 0 C-N-CA 124.316 0.96 . . . . 0.0 111.653 -174.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -79.65 113.36 17.74 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 123.892 0.877 . . . . 0.0 109.8 -177.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 40.4 mmtm -60.21 -16.76 36.21 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.926 1.29 . . . . 0.0 113.177 -177.141 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 21.4 t-160 -78.1 -12.39 59.99 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 123.742 0.817 . . . . 0.0 111.198 176.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 22.8 p -129.66 132.78 46.79 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 119.237 0.926 . . . . 0.0 113.256 -170.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -137.44 158.76 43.71 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.543 1.137 . . . . 0.0 110.77 176.824 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 88.8 p -117.71 -173.91 2.52 Favored 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 124.395 1.078 . . . . 0.0 112.8 -169.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 49.4 pttt -41.47 -54.53 3.09 Favored 'General case' 0 C--N 1.34 0.194 0 C-N-CA 126.144 1.778 . . . . 0.0 113.77 -177.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.84 -52.83 59.16 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 124.66 1.184 . . . . 0.0 108.457 -177.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -64.33 -38.59 91.57 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 123.723 0.809 . . . . 0.0 110.689 -177.441 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.4 HD12 ' CE2' ' A' ' 76' ' ' PHE . 2.7 mm? -60.95 -54.91 39.22 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 118.869 0.758 . . . . 0.0 111.299 175.245 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 53.4 mtmt -56.54 -48.53 77.06 Favored 'General case' 0 CA--C 1.53 0.201 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 179.067 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 62.9 tt0 -50.46 -59.0 4.45 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 124.174 0.989 . . . . 0.0 110.427 175.206 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.2 mt -47.1 -65.87 0.5 Allowed 'General case' 0 C--O 1.232 0.165 0 C-N-CA 124.968 1.307 . . . . 0.0 110.411 177.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 16.7 tt -62.42 -45.7 98.17 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.277 0 C-N-CA 120.04 -0.664 . . . . 0.0 109.77 -170.458 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -58.72 -51.79 68.46 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 122.836 0.454 . . . . 0.0 111.404 -179.268 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -66.26 -57.66 7.06 Favored 'General case' 0 C--N 1.339 0.11 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 -177.517 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -71.96 -61.63 1.72 Allowed 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 109.624 -0.51 . . . . 0.0 109.624 -169.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 54.7 mt -88.82 63.5 6.86 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 5.3 t -72.82 48.72 0.21 Allowed 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 124.376 1.07 . . . . 0.0 110.445 174.19 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 31.8 mt -78.5 83.0 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.518 0 N-CA-C 107.945 -1.132 . . . . 0.0 107.945 -174.23 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -46.98 -34.67 7.55 Favored Glycine 0 CA--C 1.534 1.228 0 C-N-CA 124.118 0.866 . . . . 0.0 112.209 172.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 1.1 m -59.04 -23.64 62.16 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.616 1.167 . . . . 0.0 113.807 176.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.47 ' HB3' HD11 ' A' ' 53' ' ' ILE . 34.9 mmtp 48.78 61.13 3.25 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 125.11 1.364 . . . . 0.0 111.175 179.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 84.4 mt -44.05 103.39 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 125.83 1.652 . . . . 0.0 113.325 -176.258 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 65.49 -76.64 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 126.505 1.922 . . . . 0.0 112.53 169.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -162.74 -40.01 0.04 OUTLIER 'General case' 0 C--O 1.226 -0.14 0 C-N-CA 124.65 1.18 . . . . 0.0 110.405 -171.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -38.03 -58.18 0.97 Allowed 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.648 1.179 . . . . 0.0 113.548 -171.762 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -64.21 -38.36 90.78 Favored 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 122.751 0.42 . . . . 0.0 111.196 -175.071 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.556 ' CD1' ' H ' ' A' ' 53' ' ' ILE . 0.8 OUTLIER -62.13 -54.12 38.61 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.529 0 N-CA-C 106.397 -1.705 . . . . 0.0 106.397 179.206 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 87.5 t -57.4 -42.09 79.88 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 C-N-CA 124.173 0.989 . . . . 0.0 110.566 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.05 -50.59 73.13 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 119.384 0.993 . . . . 0.0 110.886 175.13 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 42.1 mt -54.21 -45.19 72.18 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 119.396 -0.335 . . . . 0.0 110.681 177.168 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 23.2 mmt -64.94 -60.69 2.77 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 121.403 0.621 . . . . 0.0 109.499 177.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -42.7 -42.93 3.68 Favored 'General case' 0 N--CA 1.456 -0.131 0 C-N-CA 126.815 2.046 . . . . 0.0 111.521 -178.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -45.7 -45.37 14.22 Favored 'General case' 0 N--CA 1.453 -0.277 0 CA-C-O 118.517 -0.754 . . . . 0.0 112.97 178.19 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . 0.259 0.5 OUTLIER -72.04 -11.49 60.78 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 119.805 1.184 . . . . 0.0 113.209 -176.838 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -90.68 -53.89 4.22 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 118.983 0.81 . . . . 0.0 109.206 169.774 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 55.3 ttm-85 -55.23 -31.89 61.84 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.986 0.914 . . . . 0.0 110.693 179.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 70.4 m-80 -134.87 77.62 1.69 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 126.519 1.928 . . . . 0.0 109.244 175.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 43.0 mttp -70.63 -57.86 4.27 Favored 'General case' 0 N--CA 1.465 0.309 0 N-CA-C 105.233 -2.136 . . . . 0.0 105.233 168.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -149.62 58.68 1.0 Allowed 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 126.886 2.074 . . . . 0.0 105.635 168.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -122.05 165.78 15.52 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 170.357 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.9 mp0 -115.89 132.51 56.62 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 106.241 -1.763 . . . . 0.0 106.241 169.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -96.96 151.16 4.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 C-N-CA 124.266 1.026 . . . . 0.0 108.467 172.442 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -92.94 177.12 6.18 Favored 'General case' 0 N--CA 1.455 -0.175 0 C-N-CA 122.834 0.454 . . . . 0.0 111.287 176.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 79.6 t80 -41.14 -62.43 0.84 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.315 1.046 . . . . 0.0 112.034 171.32 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 39.8 tp60 -60.64 -37.42 81.43 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 119.24 0.927 . . . . 0.0 111.623 -174.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 31.1 mm-40 -61.47 -44.68 96.67 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 119.28 0.946 . . . . 0.0 111.424 173.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -53.94 -50.03 67.38 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 118.742 0.701 . . . . 0.0 109.726 172.581 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.401 ' CG2' ' CG2' ' B' ' 74' ' ' ILE . 28.1 mm -57.96 -38.27 65.7 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 O-C-N 121.901 -0.499 . . . . 0.0 110.518 176.024 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 61.3 m -64.88 -42.39 94.85 Favored 'General case' 0 C--O 1.226 -0.134 0 CA-C-N 118.824 0.738 . . . . 0.0 110.234 177.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.4 ' CE2' HD12 ' A' ' 34' ' ' LEU . 33.0 t80 -55.55 -52.69 62.88 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.429 0.691 . . . . 0.0 109.213 174.863 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 62.3 mt -60.66 -44.69 96.14 Favored 'General case' 0 CA--C 1.532 0.265 0 N-CA-C 112.255 0.465 . . . . 0.0 112.255 177.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.13 -44.41 94.12 Favored Glycine 0 CA--C 1.524 0.655 0 N-CA-C 110.623 -0.991 . . . . 0.0 110.623 -176.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -59.85 -52.13 66.74 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.252 0.621 . . . . 0.0 109.824 174.718 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 11.7 tp -47.78 -58.15 4.7 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 122.002 0.906 . . . . 0.0 110.381 175.228 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -49.67 -55.47 13.65 Favored 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 125.43 1.492 . . . . 0.0 109.857 -179.327 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 12.9 ttp -60.53 -44.31 96.19 Favored 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 123.364 0.666 . . . . 0.0 111.507 -178.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 51.7 mt -59.19 -54.61 31.9 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 CA-C-O 118.258 -0.877 . . . . 0.0 110.049 -178.36 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.391 0.6 OUTLIER -76.0 -34.22 59.71 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 118.188 -1.405 . . . . 0.0 112.964 -179.08 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 37.0 m-80 -80.33 71.06 7.11 Favored 'General case' 0 N--CA 1.465 0.276 0 O-C-N 120.654 -1.279 . . . . 0.0 108.747 170.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -46.55 -31.5 2.82 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.554 1.142 . . . . 0.0 112.798 -178.124 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -42.47 -37.75 1.71 Allowed 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 125.044 1.338 . . . . 0.0 113.729 173.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 88.4 mt -81.21 -13.65 58.34 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 112.949 0.722 . . . . 0.0 112.949 -177.61 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 48.0 mtpt -82.22 57.95 3.81 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 119.292 0.951 . . . . 0.0 110.392 -170.79 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.295 0 CA-C-O 118.209 -1.328 . . . . 0.0 113.021 -174.683 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 35.4 tpp . . . . . 0 N--CA 1.476 0.853 0 CA-C-O 121.776 0.798 . . . . 0.0 109.963 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -78.73 68.11 4.62 Favored 'General case' 0 N--CA 1.454 -0.249 0 O-C-N 121.852 -0.53 . . . . 0.0 109.764 178.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 9.6 m -54.14 160.57 2.31 Favored Pre-proline 0 CA--C 1.538 0.509 0 C-N-CA 123.309 0.643 . . . . 0.0 110.851 175.172 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_exo -42.16 -49.56 5.86 Favored 'Trans proline' 0 N--CA 1.459 -0.52 0 C-N-CA 123.775 2.983 . . . . 0.0 113.661 177.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 6.1 mt -54.52 -50.52 67.67 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-N 117.956 0.344 . . . . 0.0 111.54 173.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -63.49 -40.9 98.31 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 118.211 0.459 . . . . 0.0 110.196 -175.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 tp60 -61.89 -47.07 86.64 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 122.142 0.177 . . . . 0.0 110.694 174.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.05 -46.88 85.45 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.465 0.706 . . . . 0.0 111.02 -178.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 62.1 mt -51.4 -54.4 11.91 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 N-CA-C 107.948 -1.131 . . . . 0.0 107.948 169.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.07 -46.88 20.57 Favored Glycine 0 CA--C 1.528 0.859 0 C-N-CA 124.906 1.241 . . . . 0.0 112.183 175.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.2 mt -57.38 -54.21 49.37 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 117.59 0.695 . . . . 0.0 111.055 174.489 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -58.52 -44.07 89.37 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 118.863 0.756 . . . . 0.0 111.481 179.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 72.2 mt -54.38 -55.73 13.45 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.167 0 C-N-CA 123.462 0.705 . . . . 0.0 110.077 172.496 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.28 -51.38 51.36 Favored Glycine 0 CA--C 1.524 0.633 0 N-CA-C 110.234 -1.146 . . . . 0.0 110.234 -176.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 14.1 mm -54.5 -45.83 70.84 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.269 0 C-N-CA 122.79 0.436 . . . . 0.0 110.499 175.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -57.12 -60.19 3.98 Favored 'General case' 0 N--CA 1.455 -0.175 0 CA-C-N 118.465 0.575 . . . . 0.0 109.997 176.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 3.7 t-80 -55.34 -36.46 66.31 Favored 'General case' 0 N--CA 1.452 -0.331 0 C-N-CA 124.424 1.09 . . . . 0.0 111.511 -174.181 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 62.9 tttm -52.59 -31.06 34.4 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.566 1.146 . . . . 0.0 112.257 176.714 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -112.59 -34.08 5.94 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.764 0.711 . . . . 0.0 112.076 -179.315 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 77.8 p -74.42 -35.54 63.4 Favored 'General case' 0 N--CA 1.455 -0.182 0 CA-C-N 119.135 0.88 . . . . 0.0 110.866 179.582 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -72.45 61.76 1.5 Allowed Glycine 0 C--N 1.341 0.815 0 C-N-CA 125.181 1.372 . . . . 0.0 111.032 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -144.45 -53.28 0.32 Allowed 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 127.22 2.208 . . . . 0.0 106.715 -177.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -78.22 164.83 24.58 Favored 'General case' 0 N--CA 1.453 -0.275 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 169.328 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -61.26 -54.31 37.38 Favored Glycine 0 CA--C 1.528 0.885 0 N-CA-C 111.036 -0.826 . . . . 0.0 111.036 177.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -79.45 67.74 5.28 Favored 'General case' 0 CA--C 1.531 0.217 0 O-C-N 122.124 -0.633 . . . . 0.0 109.776 -177.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 22.2 pttp -68.79 5.2 1.16 Allowed 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 114.262 1.208 . . . . 0.0 114.262 -176.118 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 11.7 t-160 -78.34 -11.54 59.95 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 166.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 22.9 p -129.87 164.25 24.56 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 124.836 1.255 . . . . 0.0 111.419 -177.755 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -159.56 169.07 24.62 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.626 1.17 . . . . 0.0 109.364 169.716 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 78.5 p -115.94 174.16 6.18 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 -169.382 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 38.1 mtmm -26.35 -60.3 0.08 Allowed 'General case' 0 C--N 1.34 0.171 0 C-N-CA 127.764 2.426 . . . . 0.0 112.597 169.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 28.8 ttpp -53.37 -53.23 54.18 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 123.885 0.874 . . . . 0.0 110.748 -177.091 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 5.3 mp0 -61.36 -40.44 94.31 Favored 'General case' 0 C--O 1.222 -0.344 0 CA-C-O 118.967 -0.54 . . . . 0.0 110.595 179.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 31.1 mt -64.49 -48.05 76.65 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 118.934 0.788 . . . . 0.0 111.179 -179.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 68.0 mttm -58.12 -47.93 81.77 Favored 'General case' 0 N--CA 1.452 -0.358 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 176.028 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.63 -51.14 69.85 Favored 'General case' 0 C--O 1.225 -0.216 0 CA-C-N 117.762 0.255 . . . . 0.0 111.242 174.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 11.5 mt -48.18 -57.51 5.8 Favored 'General case' 0 C--N 1.331 -0.223 0 C-N-CA 124.25 1.02 . . . . 0.0 109.77 179.07 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 1.3 mp -56.84 -59.1 3.42 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 C-N-CA 120.18 -0.608 . . . . 0.0 109.831 175.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -51.33 -46.8 62.75 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 123.358 0.663 . . . . 0.0 112.372 -171.183 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.71 -64.54 1.16 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 123.709 0.804 . . . . 0.0 110.08 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 48.2 mm-40 -73.87 -24.84 59.8 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -167.177 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 96.3 mt -124.24 64.89 1.07 Allowed 'General case' 0 C--N 1.333 -0.12 0 N-CA-C 107.677 -1.231 . . . . 0.0 107.677 169.287 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 5.1 t -69.24 53.3 0.1 Allowed 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.176 1.391 . . . . 0.0 111.123 173.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 63.0 mt -78.68 76.74 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.659 0 N-CA-C 106.707 -1.59 . . . . 0.0 106.707 -178.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -48.49 -50.46 24.33 Favored Glycine 0 CA--C 1.529 0.95 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 176.047 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 6.4 m -70.96 67.43 0.41 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.282 1.033 . . . . 0.0 110.214 170.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . 0.449 ' HB3' HD11 ' B' ' 53' ' ' ILE . 27.0 mmtm -44.48 92.86 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 126.78 2.032 . . . . 0.0 112.306 -174.607 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 98.2 mt -58.47 112.85 1.73 Allowed 'General case' 0 N--CA 1.454 -0.275 0 C-N-CA 124.131 0.972 . . . . 0.0 112.51 -172.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 63.94 -79.2 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 125.387 1.475 . . . . 0.0 113.773 167.066 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -169.76 -41.65 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 118.279 0.491 . . . . 0.0 111.927 -167.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -34.77 -60.99 0.42 Allowed 'General case' 0 CA--C 1.529 0.161 0 C-N-CA 124.905 1.282 . . . . 0.0 113.72 -176.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -66.23 -33.97 76.96 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 122.588 0.355 . . . . 0.0 111.365 -174.469 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 53' ' ' ILE . . . . . 0.463 ' H ' ' CD1' ' B' ' 53' ' ' ILE . 1.0 OUTLIER -62.89 -55.73 21.87 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.322 0 N-CA-C 106.391 -1.707 . . . . 0.0 106.391 178.665 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 55.8 t -57.66 -43.82 84.3 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.308 0 CA-C-O 118.755 -0.64 . . . . 0.0 110.599 179.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.48 -51.06 69.87 Favored 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 119.233 0.924 . . . . 0.0 110.562 176.492 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 55.2 mt -56.63 -40.58 75.63 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 119.058 -0.496 . . . . 0.0 111.405 178.751 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 28.3 mmt -67.25 -65.04 0.74 Allowed 'General case' 0 CA--C 1.538 0.517 0 CA-C-N 118.919 0.781 . . . . 0.0 109.453 175.531 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -40.58 -41.93 1.57 Allowed 'General case' 0 CA--C 1.521 -0.155 0 C-N-CA 128.022 2.529 . . . . 0.0 111.939 -177.693 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 31.4 t70 -37.73 -49.17 1.13 Allowed 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 124.93 1.292 . . . . 0.0 112.287 176.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.6 pp -61.18 -42.91 99.41 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 120.958 -0.297 . . . . 0.0 111.085 -176.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -73.98 -38.3 64.19 Favored 'General case' 0 C--O 1.226 -0.173 0 C-N-CA 123.155 0.582 . . . . 0.0 110.407 -179.175 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 15.8 ttm180 -59.46 -47.98 83.39 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 123.164 0.586 . . . . 0.0 109.951 177.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -79.71 -48.8 13.06 Favored 'General case' 0 N--CA 1.457 -0.094 0 CA-C-N 116.708 -0.224 . . . . 0.0 111.264 -175.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 54.5 mttp 57.64 -97.37 0.07 Allowed 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 -166.503 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 16.9 m-20 -135.47 34.26 2.99 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.871 0.868 . . . . 0.0 110.03 172.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -123.61 143.69 50.07 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 124.581 1.152 . . . . 0.0 109.027 176.405 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 40.6 mp0 -71.59 135.87 47.16 Favored 'General case' 0 N--CA 1.451 -0.388 0 N-CA-C 108.464 -0.939 . . . . 0.0 108.464 171.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 11.7 m -80.07 145.25 9.46 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 N-CA-C 107.9 -1.148 . . . . 0.0 107.9 171.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -82.89 172.21 13.06 Favored 'General case' 0 CA--C 1.528 0.107 0 CA-C-N 117.961 0.346 . . . . 0.0 111.193 176.282 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -40.86 -61.61 0.94 Allowed 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.185 0.994 . . . . 0.0 112.146 172.161 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 38.2 tp60 -60.33 -37.04 79.36 Favored 'General case' 0 CA--C 1.533 0.302 0 O-C-N 121.224 -0.922 . . . . 0.0 111.795 -175.692 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 67.7 mm-40 -64.93 -40.82 95.62 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 121.284 -0.885 . . . . 0.0 111.488 174.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -56.43 -49.72 73.74 Favored 'General case' 0 CA--C 1.534 0.335 0 O-C-N 121.571 -0.706 . . . . 0.0 109.622 170.535 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 0.401 ' CG2' ' CG2' ' A' ' 74' ' ' ILE . 29.0 mm -56.24 -39.56 60.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.276 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 175.884 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 43.1 m -65.69 -35.74 81.63 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 118.59 0.632 . . . . 0.0 110.679 176.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 13.1 t80 -56.02 -56.25 23.06 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 171.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 67.7 mt -61.25 -40.13 92.91 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 179.089 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -69.05 -45.6 61.92 Favored Glycine 0 CA--C 1.525 0.706 0 N-CA-C 110.675 -0.97 . . . . 0.0 110.675 -176.134 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.29 -43.82 89.92 Favored 'General case' 0 N--CA 1.452 -0.327 0 O-C-N 122.112 -0.64 . . . . 0.0 110.058 175.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 12.0 tp -50.56 -57.58 7.82 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-O 121.371 0.605 . . . . 0.0 109.939 172.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.19 -50.86 48.04 Favored 'General case' 0 N--CA 1.448 -0.547 0 C-N-CA 124.441 1.096 . . . . 0.0 110.527 176.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 49.2 ttm -58.33 -47.75 82.74 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 123.715 0.806 . . . . 0.0 111.135 -178.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 93.9 mt -64.65 -52.72 51.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 CA-C-O 118.135 -0.936 . . . . 0.0 110.398 -176.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.449 0.1 OUTLIER -76.2 -38.86 55.96 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 118.521 -1.271 . . . . 0.0 113.3 -176.672 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -82.13 66.99 7.96 Favored 'General case' 0 N--CA 1.464 0.259 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 169.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -39.44 -37.8 0.5 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 125.818 1.647 . . . . 0.0 113.842 -175.188 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.99 -53.98 0.47 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 126.004 1.722 . . . . 0.0 112.502 169.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 93.2 mt -63.25 -14.41 49.07 Favored 'General case' 0 C--O 1.224 -0.267 0 C-N-CA 123.81 0.844 . . . . 0.0 113.081 -174.039 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -64.89 -33.28 75.65 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 119.894 1.225 . . . . 0.0 110.391 172.276 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.125 0 CA-C-O 117.318 -1.823 . . . . 0.0 110.622 -175.818 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 72.7 mtp . . . . . 0 N--CA 1.474 0.741 0 N-CA-C 109.824 -0.435 . . . . 0.0 109.824 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.85 67.36 3.7 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 109.139 -0.689 . . . . 0.0 109.139 171.192 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.1 m -55.56 163.09 2.04 Favored Pre-proline 0 CA--C 1.537 0.452 0 C-N-CA 124.102 0.961 . . . . 0.0 110.846 178.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_exo -43.85 -49.02 8.57 Favored 'Trans proline' 0 N--CA 1.46 -0.488 0 C-N-CA 123.62 2.88 . . . . 0.0 113.409 179.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.2 mt -55.14 -52.13 64.25 Favored 'General case' 0 C--O 1.225 -0.218 0 O-C-N 122.369 -0.207 . . . . 0.0 111.512 174.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -61.56 -41.98 98.18 Favored 'General case' 0 C--O 1.226 -0.181 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 -175.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 12.6 tp-100 -60.31 -51.25 70.33 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 123.4 0.68 . . . . 0.0 110.203 177.157 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.14 -46.15 88.58 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.291 0.636 . . . . 0.0 111.442 -177.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 56.4 mt -53.07 -51.43 38.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 170.4 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -48.61 -48.03 29.18 Favored Glycine 0 CA--C 1.525 0.688 0 C-N-CA 125.14 1.352 . . . . 0.0 111.587 175.649 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.5 mt -56.54 -54.03 50.6 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 117.652 0.726 . . . . 0.0 111.055 174.258 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 mp -58.81 -43.71 90.64 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 119.032 0.833 . . . . 0.0 111.453 -179.404 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 94.2 mt -56.52 -51.66 62.58 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 C-N-CA 123.632 0.773 . . . . 0.0 110.36 172.641 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.23 -51.58 53.19 Favored Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.046 -1.222 . . . . 0.0 110.046 -178.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 10.4 mm -57.01 -46.29 84.08 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 C-N-CA 123.158 0.583 . . . . 0.0 110.284 176.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 40.6 t80 -53.2 -59.16 4.9 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 121.211 0.529 . . . . 0.0 109.965 176.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 67.4 t60 -62.09 -33.75 75.02 Favored 'General case' 0 N--CA 1.451 -0.411 0 CA-C-N 116.126 -0.488 . . . . 0.0 111.706 -175.682 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -51.96 -45.61 64.46 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.69 0.677 . . . . 0.0 110.963 176.38 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -89.86 -49.55 6.56 Favored 'General case' 0 N--CA 1.46 0.037 0 CA-C-O 118.932 -0.556 . . . . 0.0 110.946 -178.67 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 74.8 m -49.55 -36.33 23.29 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-N 119.166 0.894 . . . . 0.0 111.384 174.652 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -30.75 -42.66 0.07 OUTLIER Glycine 0 CA--C 1.527 0.785 0 C-N-CA 127.369 2.414 . . . . 0.0 114.691 172.555 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 14.3 ptpt -80.73 -15.67 55.89 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 -173.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -101.51 126.4 48.31 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 125.052 1.341 . . . . 0.0 107.506 177.604 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -41.88 -38.66 2.5 Favored Glycine 0 CA--C 1.535 1.32 0 C-N-CA 124.562 1.077 . . . . 0.0 113.945 -175.706 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 -77.58 69.17 3.79 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.508 1.123 . . . . 0.0 108.728 170.016 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 48.0 mtmt -72.18 31.95 0.06 Allowed 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 116.038 1.866 . . . . 0.0 116.038 -168.056 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 4.7 p80 -150.36 43.95 0.86 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 124.884 1.274 . . . . 0.0 109.149 168.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -161.25 155.12 22.23 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 103.192 -2.892 . . . . 0.0 103.192 178.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -160.74 168.04 25.62 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 120.158 1.345 . . . . 0.0 112.253 177.555 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 24.7 p -113.19 176.46 5.01 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-O 121.617 0.723 . . . . 0.0 112.503 -173.42 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 20.7 pttm -40.62 -46.94 2.66 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 126.051 1.74 . . . . 0.0 112.846 174.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.0 tmmt? -59.08 -49.7 76.89 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -178.083 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 27.2 mp0 -62.98 -38.62 91.88 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 118.756 -0.64 . . . . 0.0 110.963 177.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 26.1 mt -62.43 -45.01 95.05 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 119.319 0.963 . . . . 0.0 111.182 178.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -58.3 -49.47 77.03 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 122.025 -0.422 . . . . 0.0 109.978 173.203 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 57.6 mt-10 -56.47 -43.82 79.97 Favored 'General case' 0 C--O 1.219 -0.522 0 CA-C-N 118.03 0.377 . . . . 0.0 111.449 175.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.0 mt -54.32 -56.3 19.84 Favored 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 119.296 0.953 . . . . 0.0 109.492 -178.432 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 1.3 mp -55.96 -60.7 1.55 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.322 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 175.409 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.8 tt0 -52.31 -51.42 58.74 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.649 0.78 . . . . 0.0 112.383 -171.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.1 mmpt? -73.4 -61.12 1.94 Allowed 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.987 1.315 . . . . 0.0 109.307 -175.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 60.5 mm-40 -76.71 -58.01 3.53 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 -169.896 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 85.1 mt -87.01 61.86 7.04 Favored 'General case' 0 N--CA 1.454 -0.264 0 N-CA-C 108.321 -0.992 . . . . 0.0 108.321 178.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 3.5 t -73.12 56.56 0.45 Allowed 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 124.704 1.202 . . . . 0.0 109.712 173.632 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 72.2 mt -68.39 -45.83 81.67 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.415 0 C-N-CA 125.764 1.626 . . . . 0.0 109.057 -175.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.59 -68.83 1.21 Allowed Glycine 0 CA--C 1.528 0.864 0 N-CA-C 110.522 -1.031 . . . . 0.0 110.522 -178.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.8 m -71.28 71.14 0.61 Allowed 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.286 1.034 . . . . 0.0 109.292 170.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 60.8 mmtt -46.8 95.45 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.918 1.687 . . . . 0.0 111.18 -175.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 73.5 mt -35.89 -54.62 0.75 Allowed 'General case' 0 CA--C 1.53 0.176 0 C-N-CA 126.581 1.952 . . . . 0.0 113.495 -171.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.2 tm0? -163.2 161.97 25.2 Favored 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 106.457 -1.683 . . . . 0.0 106.457 -174.701 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -35.47 -41.01 0.17 Allowed 'General case' 0 N--CA 1.462 0.153 0 C-N-CA 128.226 2.61 . . . . 0.0 114.513 -172.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.46 -58.27 0.16 Allowed 'General case' 0 CA--C 1.529 0.145 0 C-N-CA 126.08 1.752 . . . . 0.0 113.839 -177.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -70.08 -35.88 74.51 Favored 'General case' 0 CA--C 1.53 0.191 0 O-C-N 122.258 -0.276 . . . . 0.0 111.466 -173.23 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.491 HD12 ' H ' ' A' ' 53' ' ' ILE . 1.2 mp -62.72 -54.71 30.27 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.352 0 N-CA-C 106.54 -1.652 . . . . 0.0 106.54 177.064 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 72.5 t -54.21 -44.45 64.67 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 C-N-CA 124.458 1.103 . . . . 0.0 110.034 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 2.9 mptp? -57.52 -53.17 61.23 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 118.283 0.492 . . . . 0.0 110.793 175.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 71.2 mt -54.83 -37.81 66.61 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 118.965 -0.54 . . . . 0.0 111.198 178.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 27.8 mmt -66.95 -67.61 0.44 Allowed 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 118.809 0.732 . . . . 0.0 109.525 173.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -40.48 -42.62 1.66 Allowed 'General case' 0 C--N 1.341 0.199 0 C-N-CA 127.527 2.331 . . . . 0.0 111.95 -176.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -38.7 -49.64 1.59 Allowed 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 125.261 1.424 . . . . 0.0 112.492 177.095 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -63.24 -42.0 99.14 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 121.032 -0.267 . . . . 0.0 110.715 -176.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -69.52 -42.17 75.04 Favored 'General case' 0 N--CA 1.457 -0.084 0 C-N-CA 123.538 0.735 . . . . 0.0 109.602 -178.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 17.5 ttm180 -58.17 -51.45 69.7 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 124.25 1.02 . . . . 0.0 110.143 178.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 6.9 m-80 -82.47 -46.57 13.28 Favored 'General case' 0 CA--C 1.522 -0.099 0 N-CA-C 111.597 0.221 . . . . 0.0 111.597 -172.051 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 56.8 mttp 59.35 -87.58 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.49 1.116 . . . . 0.0 108.866 -168.135 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 25.8 m-20 -148.35 38.01 0.86 Allowed 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 124.996 1.319 . . . . 0.0 109.644 171.541 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -126.26 145.95 50.2 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 125.179 1.392 . . . . 0.0 107.739 175.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 22.5 mp0 -67.05 164.75 17.16 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 169.286 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 25.8 m -115.05 149.11 17.36 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.558 0 C-N-CA 125.917 1.687 . . . . 0.0 107.758 169.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -85.8 175.57 8.6 Favored 'General case' 0 C--N 1.338 0.102 0 C-N-CA 123.68 0.792 . . . . 0.0 111.015 177.454 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -41.91 -63.8 0.68 Allowed 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.806 1.242 . . . . 0.0 112.436 175.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 9.9 tp-100 -64.5 -30.45 71.48 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 120.339 1.427 . . . . 0.0 112.019 -173.276 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -66.84 -45.53 77.94 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 119.35 0.977 . . . . 0.0 110.348 175.17 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -54.72 -52.27 62.99 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 172.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 22.8 mm -55.32 -41.41 61.58 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.411 0 C-N-CA 123.102 0.561 . . . . 0.0 109.519 176.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 99.4 m -62.39 -36.04 81.08 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-N 119.089 0.859 . . . . 0.0 111.062 177.088 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 13.3 t80 -54.89 -54.57 40.8 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 118.887 0.767 . . . . 0.0 109.185 171.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 62.3 mt -63.63 -40.86 97.97 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 112.703 0.631 . . . . 0.0 112.703 -179.506 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -72.83 -44.29 38.58 Favored Glycine 0 CA--C 1.522 0.522 0 N-CA-C 110.128 -1.189 . . . . 0.0 110.128 -174.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.43 -45.11 92.44 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 121.949 -0.736 . . . . 0.0 109.795 173.255 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 12.4 tp -49.81 -58.14 5.96 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 118.802 0.728 . . . . 0.0 109.909 173.133 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -49.34 -54.03 19.19 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 124.804 1.242 . . . . 0.0 110.606 178.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 25.4 ttp -64.11 -41.54 97.21 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.252 0.621 . . . . 0.0 112.068 -176.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 80.0 mt -65.12 -51.56 64.29 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.293 0 CA-C-O 118.042 -0.98 . . . . 0.0 109.746 -178.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.46 0.1 OUTLIER -75.76 -39.3 57.34 Favored 'General case' 0 C--N 1.346 0.436 0 CA-C-N 119.713 1.142 . . . . 0.0 113.283 -178.544 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 35.7 m-80 -81.07 65.01 6.05 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 168.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -47.91 -32.86 6.8 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.94 1.296 . . . . 0.0 112.4 -169.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -32.54 -50.55 0.25 Allowed 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 126.104 1.762 . . . . 0.0 112.773 168.355 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 63.2 mt -61.53 -20.08 62.84 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 124.015 0.926 . . . . 0.0 113.322 -174.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 88.3 mttt -65.82 -26.22 67.57 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 119.512 1.051 . . . . 0.0 110.999 173.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.185 0 CA-C-O 117.279 -1.845 . . . . 0.0 111.498 -176.516 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 92.5 mmm . . . . . 0 N--CA 1.476 0.835 0 N-CA-C 110.491 -0.189 . . . . 0.0 110.491 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -79.25 63.83 3.99 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-O 121.191 0.519 . . . . 0.0 110.053 177.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 4.2 m -58.1 165.17 2.84 Favored Pre-proline 0 CA--C 1.538 0.513 0 C-N-CA 124.961 1.305 . . . . 0.0 111.365 179.193 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -44.47 -46.77 11.71 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 123.503 2.802 . . . . 0.0 113.306 177.834 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.426 HD23 ' HA ' ' B' ' 5' ' ' LEU . 5.7 mt -56.16 -51.48 67.82 Favored 'General case' 0 C--O 1.225 -0.229 0 CA-C-N 117.844 0.293 . . . . 0.0 111.577 174.123 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -57.83 -45.57 85.97 Favored 'General case' 0 N--CA 1.456 -0.159 0 N-CA-C 109.811 -0.44 . . . . 0.0 109.811 -177.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -58.73 -51.57 69.41 Favored 'General case' 0 CA--C 1.535 0.389 0 C-N-CA 122.932 0.493 . . . . 0.0 110.727 177.38 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.32 -45.41 88.0 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 123.719 0.807 . . . . 0.0 111.668 -176.158 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 78.7 mt -54.13 -52.38 38.02 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.195 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 170.475 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.15 -48.36 15.08 Favored Glycine 0 CA--C 1.528 0.855 0 C-N-CA 124.867 1.222 . . . . 0.0 111.946 174.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.3 mt -56.88 -55.85 29.15 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 117.649 0.725 . . . . 0.0 111.27 174.407 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -58.69 -42.38 88.42 Favored 'General case' 0 N--CA 1.469 0.479 0 CA-C-N 119.172 0.897 . . . . 0.0 111.711 -178.445 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 78.7 mt -54.63 -58.97 2.64 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.135 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 171.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -52.29 -48.03 54.69 Favored Glycine 0 CA--C 1.524 0.604 0 C-N-CA 124.726 1.155 . . . . 0.0 111.214 -175.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 12.5 mm -54.63 -46.58 72.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 C-N-CA 123.105 0.562 . . . . 0.0 110.386 176.395 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 26.2 t80 -61.05 -54.27 46.88 Favored 'General case' 0 CA--C 1.531 0.241 0 O-C-N 121.708 -0.62 . . . . 0.0 109.818 176.1 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -50.74 -41.72 56.81 Favored 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 125.308 1.443 . . . . 0.0 111.435 -176.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -55.58 -34.01 64.41 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.934 1.293 . . . . 0.0 112.407 179.312 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 47.1 m-85 -109.06 -57.45 2.15 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 123.587 0.755 . . . . 0.0 110.896 -176.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -73.93 -48.71 28.71 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 123.504 0.722 . . . . 0.0 110.244 -177.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.45 64.19 3.25 Favored Glycine 0 C--N 1.336 0.541 0 CA-C-N 115.9 -0.591 . . . . 0.0 112.681 -168.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 20.4 mmmt -106.06 -166.27 1.18 Allowed 'General case' 0 N--CA 1.447 -0.579 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 169.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 26.3 mm-40 -78.65 65.7 3.97 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 123.149 0.58 . . . . 0.0 109.742 -179.446 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -165.63 -145.37 4.4 Favored Glycine 0 CA--C 1.527 0.828 0 N-CA-C 110.32 -1.112 . . . . 0.0 110.32 -177.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -78.75 62.63 3.31 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 124.591 1.156 . . . . 0.0 110.568 -174.118 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.79 -20.97 2.46 Favored 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 116.475 2.028 . . . . 0.0 116.475 -169.497 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 21.9 t-160 -78.51 -19.57 52.68 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 124.493 1.117 . . . . 0.0 111.552 179.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 1.1 p -130.57 158.68 39.33 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 125.107 1.363 . . . . 0.0 112.606 -168.452 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.94 -179.79 7.84 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.055 1.342 . . . . 0.0 108.553 169.423 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 7.3 t -141.6 -163.21 1.52 Allowed 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 119.355 0.98 . . . . 0.0 112.673 -178.127 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 8.6 mtpm? -36.79 -69.12 0.12 Allowed 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 128.716 2.806 . . . . 0.0 113.662 -169.189 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -55.38 -46.97 76.5 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 122.772 0.429 . . . . 0.0 110.068 -173.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -61.32 -44.12 97.74 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 123.797 0.839 . . . . 0.0 110.712 -179.768 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 51.7 mt -61.31 -52.98 62.43 Favored 'General case' 0 CA--C 1.53 0.209 0 CA-C-N 118.341 0.519 . . . . 0.0 111.015 177.072 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 47.9 mtpt -60.92 -42.61 98.46 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -177.786 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 66.4 mt-10 -54.61 -55.58 28.02 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-O 118.962 -0.542 . . . . 0.0 110.904 169.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 9.1 mt -47.36 -58.89 3.63 Favored 'General case' 0 N--CA 1.457 -0.103 0 C-N-CA 123.406 0.682 . . . . 0.0 110.193 -178.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 13.3 tt -59.34 -55.18 25.39 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.329 0 C-N-CA 119.766 -0.774 . . . . 0.0 110.54 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 19.6 tt0 -58.41 -46.05 87.18 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 118.435 0.562 . . . . 0.0 112.438 -172.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -76.76 -51.08 12.07 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 123.509 0.724 . . . . 0.0 110.093 -177.263 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -83.54 -28.7 28.43 Favored 'General case' 0 CA--C 1.53 0.179 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -168.247 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 32.7 mt -96.27 86.96 4.35 Favored 'General case' 0 C--N 1.338 0.069 0 N-CA-C 106.412 -1.699 . . . . 0.0 106.412 168.483 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 72.3 p -77.3 56.65 1.36 Allowed 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 124.848 1.259 . . . . 0.0 109.063 -178.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 36.3 mt -75.02 -58.84 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.605 0 C-N-CA 124.395 1.078 . . . . 0.0 108.426 -174.282 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 68.61 -71.68 0.37 Allowed Glycine 0 CA--C 1.529 0.942 0 N-CA-C 110.092 -1.203 . . . . 0.0 110.092 -174.655 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 19.3 m -63.6 80.27 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 125.629 1.572 . . . . 0.0 110.146 172.404 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 11.6 mmtm -39.96 91.52 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 127.358 2.263 . . . . 0.0 112.2 178.096 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 89.3 mt -52.68 -54.15 37.42 Favored 'General case' 0 CA--C 1.53 0.179 0 C-N-CA 124.569 1.148 . . . . 0.0 111.921 -173.105 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.4 tm0? -164.77 160.61 19.84 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 -174.468 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -38.12 -42.06 0.63 Allowed 'General case' 0 C--O 1.227 -0.113 0 C-N-CA 127.474 2.31 . . . . 0.0 114.397 -171.474 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.58 -61.57 0.14 Allowed 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 125.594 1.558 . . . . 0.0 114.146 -175.217 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -60.31 -43.15 96.62 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.298 0.639 . . . . 0.0 111.333 -175.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 53' ' ' ILE . . . . . 0.526 ' H ' ' CD1' ' B' ' 53' ' ' ILE . 1.0 OUTLIER -62.16 -51.99 65.79 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.365 0 N-CA-C 106.066 -1.827 . . . . 0.0 106.066 -178.785 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 70.7 t -55.3 -40.02 54.74 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.613 0 CA-C-N 114.891 -1.05 . . . . 0.0 110.239 178.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.84 -52.81 63.48 Favored 'General case' 0 CA--C 1.521 -0.148 0 CA-C-N 120.214 1.37 . . . . 0.0 110.517 174.741 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 57.1 mt -53.52 -39.57 64.74 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 119.573 -0.251 . . . . 0.0 110.683 -178.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 22.9 mmt -71.12 -64.23 0.95 Allowed 'General case' 0 CA--C 1.539 0.53 0 CA-C-O 121.424 0.63 . . . . 0.0 110.003 175.54 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.01 -29.4 60.29 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 125.041 1.336 . . . . 0.0 112.212 -169.718 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -39.52 -50.69 2.19 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 124.632 1.173 . . . . 0.0 111.037 170.584 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 54.1 mt -58.82 -47.08 86.07 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.125 -176.421 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -69.73 -46.43 65.93 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.439 0.696 . . . . 0.0 111.283 -178.128 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 50.9 ttt85 -56.84 -52.22 65.94 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 124.972 1.309 . . . . 0.0 109.414 -179.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -78.87 -56.8 4.12 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 116.625 -0.261 . . . . 0.0 111.556 -176.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 45.1 mttm 64.82 -78.01 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.738 1.215 . . . . 0.0 109.041 -167.531 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 17.6 m-20 -147.57 20.54 1.18 Allowed 'General case' 0 N--CA 1.464 0.272 0 C-N-CA 125.572 1.549 . . . . 0.0 110.49 171.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 30.1 mt-30 -97.19 144.34 27.11 Favored 'General case' 0 N--CA 1.448 -0.562 0 C-N-CA 124.188 0.995 . . . . 0.0 108.82 -177.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -82.12 142.25 32.41 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 167.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 20.9 m -99.89 146.49 8.79 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 108.0 -1.111 . . . . 0.0 108.0 169.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -85.36 176.02 8.54 Favored 'General case' 0 CA--C 1.529 0.14 0 C-N-CA 123.418 0.687 . . . . 0.0 111.271 175.885 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -40.65 -63.82 0.6 Allowed 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.306 1.043 . . . . 0.0 112.533 172.421 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 61.6 tp60 -61.03 -36.21 78.92 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 119.755 1.161 . . . . 0.0 111.671 -175.425 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 49.0 mt-10 -64.37 -35.84 82.18 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.255 -0.903 . . . . 0.0 111.081 175.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -62.97 -46.8 86.02 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.507 -0.746 . . . . 0.0 109.626 169.361 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 24.2 mm -60.63 -29.19 44.35 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 O-C-N 121.49 -0.756 . . . . 0.0 110.513 176.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 25.3 m -67.2 -45.13 77.8 Favored 'General case' 0 C--O 1.227 -0.1 0 O-C-N 121.232 -0.917 . . . . 0.0 109.411 171.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 15.5 t80 -52.32 -54.99 24.51 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 173.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 38.8 mt -59.44 -46.36 88.98 Favored 'General case' 0 CA--C 1.529 0.168 0 O-C-N 121.727 -0.608 . . . . 0.0 111.691 177.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -57.57 -45.68 92.91 Favored Glycine 0 CA--C 1.525 0.699 0 N-CA-C 110.91 -0.876 . . . . 0.0 110.91 -179.261 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -62.97 -51.74 65.71 Favored 'General case' 0 N--CA 1.449 -0.488 0 C-N-CA 123.493 0.717 . . . . 0.0 110.023 177.281 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -47.36 -58.68 3.87 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.95 0.881 . . . . 0.0 110.272 174.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.08 -56.61 11.73 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 125.18 1.392 . . . . 0.0 110.643 -179.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 12.8 ttp -67.05 -39.15 86.84 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.607 0.763 . . . . 0.0 111.806 -174.372 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 64.5 mt -63.74 -51.76 65.75 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.314 0 CA-C-O 117.807 -1.092 . . . . 0.0 109.195 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.474 0.3 OUTLIER -75.25 -38.15 60.67 Favored 'General case' 0 C--N 1.348 0.5 0 CA-C-N 119.897 1.226 . . . . 0.0 113.319 -179.867 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 40.9 m-80 -80.57 61.88 4.44 Favored 'General case' 0 N--CA 1.464 0.262 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 168.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -52.26 -25.01 8.31 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.532 1.133 . . . . 0.0 112.55 -175.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -38.6 -46.72 1.23 Allowed 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 125.164 1.385 . . . . 0.0 111.845 167.366 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 84.4 mt -66.85 -25.03 66.23 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.12 0.968 . . . . 0.0 113.041 -178.218 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt -80.15 -44.42 19.91 Favored 'General case' 0 CA--C 1.53 0.185 0 N-CA-C 108.69 -0.855 . . . . 0.0 108.69 171.146 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.13 0 CA-C-O 117.427 -1.763 . . . . 0.0 110.386 174.116 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 ppp? . . . . . 0 N--CA 1.477 0.903 0 N-CA-C 113.072 0.767 . . . . 0.0 113.072 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -71.83 80.7 0.88 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.99 0.916 . . . . 0.0 111.431 -173.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 78.7 p -60.69 167.4 3.4 Favored Pre-proline 0 CA--C 1.536 0.418 0 C-N-CA 124.414 1.086 . . . . 0.0 112.2 175.479 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -50.57 -44.3 40.84 Favored 'Trans proline' 0 N--CA 1.455 -0.79 0 C-N-CA 122.619 2.213 . . . . 0.0 111.215 168.245 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.415 HD23 ' HA ' ' A' ' 5' ' ' LEU . 4.8 mt -53.65 -57.49 10.61 Favored 'General case' 0 C--N 1.342 0.252 0 CA-C-O 119.448 -0.31 . . . . 0.0 111.671 170.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -52.57 -47.65 66.68 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 120.848 0.356 . . . . 0.0 110.356 -177.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 -59.39 -49.41 77.92 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.921 0.888 . . . . 0.0 110.919 178.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.77 -46.63 88.74 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.866 0.866 . . . . 0.0 111.132 -178.084 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 83.1 mt -54.67 -51.41 51.41 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 172.057 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.72 -50.35 14.78 Favored Glycine 0 CA--C 1.53 0.991 0 C-N-CA 124.562 1.077 . . . . 0.0 111.963 173.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 mt -54.65 -54.37 42.52 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-N 117.721 0.761 . . . . 0.0 110.936 175.297 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 9.8 mp -58.71 -43.68 90.17 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 118.79 0.723 . . . . 0.0 111.687 -178.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 97.3 mt -58.59 -52.18 62.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.326 0 C-N-CA 123.22 0.608 . . . . 0.0 110.433 174.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.96 -54.55 34.51 Favored Glycine 0 CA--C 1.524 0.594 0 N-CA-C 109.942 -1.263 . . . . 0.0 109.942 -178.325 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 6.0 mm -50.01 -50.11 20.12 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.25 0 C-N-CA 123.843 0.857 . . . . 0.0 109.911 174.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -52.89 -62.71 1.47 Allowed 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 179.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 5.7 m-70 -63.38 -23.57 67.47 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 -175.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.8 ttpp -53.94 -24.69 17.28 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 118.782 0.719 . . . . 0.0 111.97 170.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -116.95 -37.34 3.61 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.044 0.938 . . . . 0.0 112.792 175.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 75.5 p -79.82 -32.01 40.64 Favored 'General case' 0 CA--C 1.528 0.125 0 CA-C-N 119.515 1.052 . . . . 0.0 112.164 -178.169 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.1 61.77 3.4 Favored Glycine 0 CA--C 1.527 0.802 0 C-N-CA 124.249 0.928 . . . . 0.0 112.088 -169.905 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 33.1 mtmm -98.21 -82.92 0.42 Allowed 'General case' 0 N--CA 1.451 -0.384 0 C-N-CA 124.552 1.141 . . . . 0.0 109.571 -176.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -148.65 159.99 43.57 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.704 1.201 . . . . 0.0 108.057 -177.3 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 54.49 -107.43 0.68 Allowed Glycine 0 CA--C 1.529 0.918 0 C-N-CA 123.931 0.777 . . . . 0.0 112.301 174.072 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 40.9 t0 -79.82 61.93 3.9 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-O 121.876 0.846 . . . . 0.0 110.25 -174.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 6.0 mtmp? -59.96 -16.73 32.47 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 125.064 1.346 . . . . 0.0 113.454 -172.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 6.5 p-80 -89.46 9.71 25.41 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 175.36 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 74.6 p -123.06 164.63 18.23 Favored 'General case' 0 C--N 1.34 0.157 0 CA-C-N 118.828 0.74 . . . . 0.0 111.318 174.088 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -159.69 -165.04 1.44 Allowed 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.211 1.404 . . . . 0.0 107.44 169.498 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 9.2 m -156.88 -179.5 8.26 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 119.371 0.987 . . . . 0.0 111.633 -171.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -19.72 -72.98 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 129.247 3.019 . . . . 0.0 114.429 176.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 39.8 ttpt -53.42 -52.16 60.27 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.515 1.126 . . . . 0.0 109.785 -175.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -58.86 -42.84 90.33 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-O 118.725 -0.655 . . . . 0.0 111.124 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 13.4 mt -61.55 -50.03 74.3 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 119.141 0.882 . . . . 0.0 111.459 176.486 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 62.0 mtpt -58.55 -46.41 86.92 Favored 'General case' 0 CA--C 1.533 0.315 0 O-C-N 122.191 -0.318 . . . . 0.0 110.221 179.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.81 -51.88 67.24 Favored 'General case' 0 C--O 1.224 -0.259 0 C-N-CA 122.856 0.463 . . . . 0.0 110.998 173.773 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.0 mt -46.53 -61.1 1.97 Allowed 'General case' 0 C--N 1.333 -0.151 0 C-N-CA 123.747 0.819 . . . . 0.0 110.561 177.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 16.8 tt -59.41 -52.24 63.23 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 C-N-CA 119.829 -0.748 . . . . 0.0 110.157 -178.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -53.99 -50.35 66.79 Favored 'General case' 0 CA--C 1.539 0.558 0 C-N-CA 123.604 0.761 . . . . 0.0 112.456 -175.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.06 -53.04 7.86 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 123.629 0.771 . . . . 0.0 110.266 -176.77 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 49.2 mm-40 -81.16 -24.38 37.6 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -167.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 47.4 mt -105.94 84.01 2.0 Allowed 'General case' 0 CA--C 1.527 0.074 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 169.446 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 52.6 p -75.2 57.41 0.86 Allowed 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 125.479 1.512 . . . . 0.0 109.109 178.174 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 30.0 mt -73.25 -51.75 24.64 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.62 0 C-N-CA 124.073 0.949 . . . . 0.0 108.619 -175.31 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 71.61 -67.72 1.0 Allowed Glycine 0 CA--C 1.528 0.876 0 N-CA-C 110.408 -1.077 . . . . 0.0 110.408 -176.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 19.8 m -69.24 74.42 0.34 Allowed 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 125.191 1.397 . . . . 0.0 110.227 174.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -32.85 90.94 0.0 OUTLIER 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 128.011 2.524 . . . . 0.0 112.785 -179.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 83.8 mt -65.35 112.43 3.5 Favored 'General case' 0 C--O 1.233 0.212 0 C-N-CA 123.93 0.892 . . . . 0.0 112.34 -169.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.3 tt0 63.48 -77.4 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.553 1.541 . . . . 0.0 113.292 167.16 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -166.58 -46.61 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 123.921 0.888 . . . . 0.0 110.194 -169.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -36.4 -62.98 0.42 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.966 1.306 . . . . 0.0 113.415 -175.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 73.1 tt0 -59.35 -43.05 92.86 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.85 0.86 . . . . 0.0 111.004 -178.605 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.488 ' CD1' ' H ' ' A' ' 53' ' ' ILE . 0.9 OUTLIER -60.89 -53.72 45.24 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.479 0 N-CA-C 106.49 -1.67 . . . . 0.0 106.49 -173.834 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 66.6 t -56.01 -58.68 4.24 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.65 0 CA-C-O 118.154 -0.927 . . . . 0.0 108.647 176.256 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -41.22 -51.52 3.51 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 119.038 0.835 . . . . 0.0 112.403 -178.738 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 27.0 mt -55.92 -43.78 77.66 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 -176.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 1.4 mpp? -82.07 -58.34 3.01 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 123.958 0.903 . . . . 0.0 109.997 -179.585 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -42.78 -31.29 0.46 Allowed 'General case' 0 C--O 1.222 -0.388 0 C-N-CA 126.671 1.988 . . . . 0.0 111.954 176.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.4 t70 -37.2 -43.44 0.51 Allowed 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.587 1.155 . . . . 0.0 113.261 172.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -58.02 -57.58 12.2 Favored 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.51 -0.744 . . . . 0.0 110.115 177.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -58.61 -45.41 89.25 Favored 'General case' 0 C--O 1.224 -0.289 0 C-N-CA 124.381 1.073 . . . . 0.0 110.361 179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 43.0 tpt85 -50.13 -46.0 53.51 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 126.074 1.75 . . . . 0.0 110.785 177.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 4.0 m-80 -78.1 -32.93 50.85 Favored 'General case' 0 C--O 1.226 -0.172 0 O-C-N 123.508 0.505 . . . . 0.0 111.403 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 44.5 mmtm 57.79 28.1 15.46 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.528 0.731 . . . . 0.0 109.589 -167.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 52.6 33.97 14.75 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.638 1.175 . . . . 0.0 112.61 -170.126 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -120.47 157.82 28.56 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 124.895 1.278 . . . . 0.0 108.09 169.403 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -62.1 152.85 31.64 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 123.277 0.631 . . . . 0.0 110.657 174.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -122.35 143.69 34.21 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 C-N-CA 124.898 1.279 . . . . 0.0 108.647 175.246 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 17.4 p30 -92.77 -177.59 4.59 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 125.162 1.385 . . . . 0.0 111.589 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 49.4 t80 -47.37 -60.63 2.38 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.677 0.791 . . . . 0.0 112.769 175.696 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 47.8 tp60 -63.17 -34.63 78.05 Favored 'General case' 0 CA--C 1.528 0.122 0 CA-C-N 119.489 1.041 . . . . 0.0 110.579 -175.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 72.2 mm-40 -58.26 -49.86 75.61 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.943 -0.473 . . . . 0.0 110.498 173.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -55.15 -50.02 70.35 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 122.947 0.499 . . . . 0.0 110.512 173.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 26.3 mm -57.26 -34.3 45.52 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 C-N-CA 123.207 0.603 . . . . 0.0 110.534 177.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 61.1 m -71.13 -39.29 72.09 Favored 'General case' 0 CA--C 1.531 0.227 0 O-C-N 121.568 -0.708 . . . . 0.0 110.684 176.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 73.8 t80 -57.17 -53.75 54.62 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 118.902 0.774 . . . . 0.0 109.959 173.26 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 53.6 mt -58.57 -42.35 87.77 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 120.804 0.335 . . . . 0.0 110.854 174.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.42 -46.05 88.09 Favored Glycine 0 CA--C 1.524 0.608 0 C-N-CA 124.244 0.926 . . . . 0.0 111.083 179.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.3 -49.28 74.63 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.362 0.665 . . . . 0.0 110.001 177.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -49.49 -59.63 3.58 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-O 122.472 1.13 . . . . 0.0 109.879 176.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -49.01 -59.75 3.35 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 113.663 -1.608 . . . . 0.0 110.254 178.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 22.7 ttp -63.87 -40.27 96.15 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.199 0.6 . . . . 0.0 112.004 -173.644 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 70.0 mt -62.94 -48.94 85.63 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 CA-C-O 117.77 -1.11 . . . . 0.0 109.679 -179.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.43 1.2 p90 -79.02 -33.54 44.75 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 117.812 -1.555 . . . . 0.0 113.975 179.117 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 32.1 m-80 -79.98 89.01 5.32 Favored 'General case' 0 C--N 1.334 -0.066 0 O-C-N 121.019 -1.051 . . . . 0.0 109.66 175.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -42.04 -42.32 2.84 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 123.573 0.749 . . . . 0.0 111.082 169.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -67.23 16.77 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 114.854 1.428 . . . . 0.0 114.854 178.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 46.9 mt -130.26 2.91 4.7 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 125.136 1.374 . . . . 0.0 112.533 170.292 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 29.4 mmtp -66.61 85.24 0.11 Allowed 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 119.839 1.199 . . . . 0.0 111.561 -171.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.339 0 CA-C-O 117.206 -1.886 . . . . 0.0 109.544 176.434 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.6 ppp? . . . . . 0 N--CA 1.478 0.953 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -80.8 65.74 6.06 Favored 'General case' 0 CA--C 1.532 0.274 0 O-C-N 121.625 -0.672 . . . . 0.0 111.581 -173.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.4 m -58.9 167.47 1.92 Allowed Pre-proline 0 CA--C 1.539 0.53 0 C-N-CA 124.688 1.195 . . . . 0.0 111.404 175.525 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_exo -48.27 -47.57 19.41 Favored 'Trans proline' 0 N--CA 1.457 -0.627 0 C-N-CA 123.234 2.623 . . . . 0.0 112.988 178.091 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.2 mt -57.11 -49.74 74.95 Favored 'General case' 0 C--O 1.224 -0.278 0 C-N-CA 120.672 -0.411 . . . . 0.0 111.391 173.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -59.12 -40.43 85.38 Favored 'General case' 0 C--O 1.225 -0.188 0 CA-C-N 118.614 0.643 . . . . 0.0 110.276 -177.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -63.02 -52.3 63.42 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.405 0.682 . . . . 0.0 110.703 176.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.47 -46.3 89.11 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 123.599 0.76 . . . . 0.0 111.322 -177.788 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 74.2 mt -52.88 -57.45 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 169.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -43.56 -46.41 7.13 Favored Glycine 0 CA--C 1.527 0.819 0 C-N-CA 125.925 1.726 . . . . 0.0 112.456 177.408 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 mt -54.7 -57.12 12.76 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.681 0.792 . . . . 0.0 110.774 172.742 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 11.0 mp -57.62 -42.02 82.47 Favored 'General case' 0 CA--C 1.541 0.602 0 O-C-N 121.52 -0.737 . . . . 0.0 111.976 178.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 18.6 mt -57.36 -56.42 15.22 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.226 0 C-N-CA 123.828 0.851 . . . . 0.0 110.08 175.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.92 -49.79 60.98 Favored Glycine 0 CA--C 1.52 0.404 0 N-CA-C 109.723 -1.351 . . . . 0.0 109.723 -177.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.8 mm -53.84 -46.86 63.99 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.28 0 C-N-CA 122.734 0.413 . . . . 0.0 110.558 175.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . 0.408 ' HB2' ' CE2' ' B' ' 73' ' ' TYR . 42.3 t80 -56.61 -64.2 0.95 Allowed 'General case' 0 N--CA 1.457 -0.114 0 CA-C-N 118.529 0.604 . . . . 0.0 110.004 175.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.2 t60 -58.28 -34.96 71.09 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 119.351 -0.356 . . . . 0.0 111.313 -169.774 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 64.8 tttm -50.48 -36.61 34.46 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.7 0.8 . . . . 0.0 112.177 175.514 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 77.3 m-85 -104.29 -41.95 5.63 Favored 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 123.186 0.595 . . . . 0.0 111.4 -178.404 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 96.5 p -70.18 -36.32 74.57 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 121.556 -0.715 . . . . 0.0 111.349 -177.307 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -44.39 -44.18 7.88 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 124.938 1.256 . . . . 0.0 113.482 -173.4 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 6.6 ptpt -77.65 -16.02 58.8 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 113.391 0.886 . . . . 0.0 113.391 -175.163 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 53.7 mm-40 -78.24 37.83 0.27 Allowed 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 119.314 0.961 . . . . 0.0 112.819 -169.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 65.12 -75.08 0.08 OUTLIER Glycine 0 CA--C 1.53 0.985 0 C-N-CA 124.395 0.998 . . . . 0.0 111.165 -177.175 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 63.6 t0 -77.89 81.55 4.3 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 106.532 -1.655 . . . . 0.0 106.532 171.446 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 39.4 mtmt -36.23 -35.31 0.07 Allowed 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 128.019 2.528 . . . . 0.0 114.508 -177.378 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 16.3 m170 -94.76 17.4 13.62 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.768 0.827 . . . . 0.0 112.202 -172.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 51.7 p -141.73 162.04 36.45 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 124.104 0.961 . . . . 0.0 110.036 177.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -161.21 179.8 8.07 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 118.045 -0.979 . . . . 0.0 108.92 172.329 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.3 t -137.93 -168.04 2.27 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-N 120.421 1.464 . . . . 0.0 112.254 -178.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 14.9 pttp -45.69 -51.41 12.45 Favored 'General case' 0 C--N 1.337 0.06 0 C-N-CA 126.318 1.847 . . . . 0.0 112.969 -169.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 39.6 ttpt -53.34 -49.88 66.17 Favored 'General case' 0 N--CA 1.45 -0.457 0 C-N-CA 122.99 0.516 . . . . 0.0 110.346 179.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 19.1 mp0 -68.06 -37.12 80.93 Favored 'General case' 0 N--CA 1.45 -0.426 0 CA-C-O 119.272 -0.394 . . . . 0.0 110.419 -178.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 43.7 mt -62.91 -45.94 90.14 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 118.928 0.786 . . . . 0.0 110.93 177.18 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -57.57 -50.87 71.69 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 173.064 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 59.4 tt0 -51.42 -53.29 38.28 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.056 0.942 . . . . 0.0 110.594 178.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 12.8 mt -52.22 -65.08 0.62 Allowed 'General case' 0 N--CA 1.452 -0.359 0 C-N-CA 125.839 1.656 . . . . 0.0 109.82 177.108 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 14.3 tt -59.4 -45.51 93.44 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 120.037 -0.665 . . . . 0.0 109.934 -173.067 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 20.3 tt0 -51.16 -59.39 4.24 Favored 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 123.681 0.792 . . . . 0.0 111.551 177.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 9.1 mttm -78.33 -53.6 7.11 Favored 'General case' 0 CA--C 1.521 -0.155 0 CA-C-O 121.388 0.613 . . . . 0.0 110.815 -173.234 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 68.0 mm-40 -77.14 -21.45 54.12 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 118.278 -0.868 . . . . 0.0 112.924 -169.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 11.1 mt -113.98 89.12 3.01 Favored 'General case' 0 N--CA 1.461 0.095 0 CA-C-N 120.263 1.392 . . . . 0.0 108.948 170.185 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 1.7 p -69.66 34.03 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.98 2.112 . . . . 0.0 113.179 -179.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 28.6 mt -83.47 69.36 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 -179.545 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -57.42 -47.29 89.13 Favored Glycine 0 CA--C 1.528 0.877 0 N-CA-C 109.284 -1.526 . . . . 0.0 109.284 171.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 26.4 p -71.13 75.8 0.68 Allowed 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 123.963 0.905 . . . . 0.0 108.611 169.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 62.3 mttm -48.23 94.69 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.552 1.541 . . . . 0.0 110.932 177.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 94.8 mt -48.46 -51.39 27.26 Favored 'General case' 0 CA--C 1.529 0.165 0 C-N-CA 125.145 1.378 . . . . 0.0 112.555 -170.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -162.89 161.55 25.9 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 106.1 -1.815 . . . . 0.0 106.1 -173.056 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -37.17 -40.74 0.34 Allowed 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 127.671 2.388 . . . . 0.0 114.146 -171.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.34 -56.31 0.15 Allowed 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 126.1 1.76 . . . . 0.0 114.479 -179.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 62.6 tt0 -63.8 -44.61 92.79 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 121.257 0.551 . . . . 0.0 110.9 -175.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 53' ' ' ILE . . . . . 0.584 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.5 mp -61.25 -52.5 60.68 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 179.855 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 73.4 t -56.29 -44.55 79.93 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 C-N-CA 124.249 1.02 . . . . 0.0 110.231 -179.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -53.92 -55.13 29.74 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 119.194 0.906 . . . . 0.0 110.497 173.013 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 46.4 mt -53.78 -42.87 68.75 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 119.18 -0.438 . . . . 0.0 111.524 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 24.5 mmt -68.45 -61.79 1.68 Allowed 'General case' 0 CA--C 1.538 0.503 0 CA-C-O 121.765 0.793 . . . . 0.0 109.832 178.22 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -43.89 -43.52 6.45 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 127.085 2.154 . . . . 0.0 111.199 -177.388 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -39.13 -49.07 1.79 Allowed 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.831 1.253 . . . . 0.0 112.42 178.229 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -60.03 -56.35 22.71 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 118.28 0.491 . . . . 0.0 109.89 -177.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -61.79 -35.5 78.36 Favored 'General case' 0 CA--C 1.529 0.138 0 C-N-CA 124.291 1.037 . . . . 0.0 111.482 -177.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 10.9 ttp180 -67.11 -52.24 44.28 Favored 'General case' 0 N--CA 1.449 -0.523 0 C-N-CA 123.759 0.824 . . . . 0.0 109.611 179.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -76.69 -58.38 3.32 Favored 'General case' 0 CA--C 1.52 -0.181 0 CA-C-O 119.628 -0.225 . . . . 0.0 110.558 -171.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 47.1 mtmt 48.56 44.77 21.1 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 121.193 0.521 . . . . 0.0 110.13 -169.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 70.74 -4.18 1.76 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.249 1.82 . . . . 0.0 113.927 -178.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -69.06 141.95 54.65 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-N 119.491 1.041 . . . . 0.0 109.1 176.086 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 41.5 mp0 -79.52 114.87 18.79 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 108.733 -0.839 . . . . 0.0 108.733 174.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 20.1 m -79.02 151.48 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.298 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 173.371 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 2.0 p-10 -93.15 -175.93 4.0 Favored 'General case' 0 CA--C 1.528 0.123 0 C-N-CA 123.832 0.853 . . . . 0.0 111.179 178.221 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -46.72 -66.08 0.46 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.109 0.964 . . . . 0.0 112.622 175.458 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 10.3 tp-100 -61.39 -35.1 76.54 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 119.756 1.162 . . . . 0.0 111.454 -174.056 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 -64.51 -42.51 95.77 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-N 119.408 1.004 . . . . 0.0 111.252 175.424 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 73' ' ' TYR . . . . . 0.408 ' CE2' ' HB2' ' B' ' 16' ' ' PHE . 0.3 OUTLIER -54.81 -52.7 61.87 Favored 'General case' 0 CA--C 1.533 0.313 0 O-C-N 121.286 -0.884 . . . . 0.0 109.686 170.069 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 20.8 mm -53.68 -40.61 43.53 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.375 0 C-N-CA 122.947 0.499 . . . . 0.0 109.665 177.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 91.5 m -63.63 -28.37 69.87 Favored 'General case' 0 C--N 1.332 -0.178 0 C-N-CA 123.592 0.757 . . . . 0.0 111.338 178.307 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 10.7 t80 -60.51 -54.51 44.66 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.384 0.993 . . . . 0.0 108.996 171.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 70.1 mt -64.44 -37.98 89.44 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.183 0.593 . . . . 0.0 111.703 179.889 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -70.63 -45.03 55.6 Favored Glycine 0 CA--C 1.523 0.541 0 N-CA-C 110.047 -1.221 . . . . 0.0 110.047 -176.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.88 -46.24 90.25 Favored 'General case' 0 N--CA 1.452 -0.336 0 O-C-N 122.294 -0.533 . . . . 0.0 109.898 173.456 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 26.4 tp -51.52 -57.99 7.55 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-O 121.211 0.529 . . . . 0.0 109.882 175.132 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.14 -51.99 38.84 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 124.42 1.088 . . . . 0.0 110.691 177.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 57.7 ttm -56.47 -51.01 70.06 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 124.316 1.047 . . . . 0.0 110.82 -178.515 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.3 mt -66.35 -51.03 63.02 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.437 0 CA-C-O 118.088 -0.958 . . . . 0.0 109.882 -173.507 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.464 0.1 OUTLIER -76.98 -40.25 47.47 Favored 'General case' 0 C--N 1.347 0.478 0 CA-C-N 119.716 1.144 . . . . 0.0 113.373 -177.302 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 19.3 m-80 -82.98 64.88 7.83 Favored 'General case' 0 N--CA 1.461 0.077 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 169.166 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -47.38 -26.49 1.32 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.945 1.698 . . . . 0.0 113.961 -172.018 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -38.81 -45.16 1.11 Allowed 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.505 1.522 . . . . 0.0 111.92 167.503 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 86.8 mt -67.92 6.65 0.66 Allowed 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.235 1.414 . . . . 0.0 113.758 -177.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 9.5 mtmp? -106.77 -4.53 19.26 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 119.517 1.053 . . . . 0.0 111.253 169.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.097 0 CA-C-O 117.663 -1.632 . . . . 0.0 110.675 -177.131 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.8 ptm . . . . . 0 N--CA 1.478 0.928 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -73.63 76.93 1.51 Allowed 'General case' 0 CA--C 1.53 0.197 0 C-N-CA 123.409 0.684 . . . . 0.0 111.98 -170.601 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -53.5 163.82 0.95 Allowed Pre-proline 0 CA--C 1.54 0.568 0 C-N-CA 126.404 1.881 . . . . 0.0 111.627 172.552 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_endo -51.65 -47.48 26.07 Favored 'Trans proline' 0 N--CA 1.457 -0.632 0 C-N-CA 122.804 2.336 . . . . 0.0 112.309 176.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.421 HD23 ' HA ' ' A' ' 5' ' ' LEU . 8.6 mt -58.41 -50.43 73.71 Favored 'General case' 0 C--O 1.224 -0.254 0 CA-C-N 118.322 0.51 . . . . 0.0 110.696 175.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -53.89 -48.81 69.73 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 118.147 0.431 . . . . 0.0 109.917 -178.119 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 -57.78 -52.48 65.28 Favored 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 123.864 0.865 . . . . 0.0 110.919 177.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.31 -44.53 87.58 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.272 0.629 . . . . 0.0 111.781 -174.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 80.8 mt -54.54 -51.62 48.42 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 N-CA-C 107.982 -1.118 . . . . 0.0 107.982 170.221 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.28 -49.64 14.37 Favored Glycine 0 CA--C 1.528 0.9 0 C-N-CA 124.358 0.98 . . . . 0.0 111.773 173.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.1 mt -55.61 -56.7 17.27 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-N 117.642 0.721 . . . . 0.0 111.094 174.561 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 9.9 mp -58.0 -43.39 86.58 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 119.357 0.98 . . . . 0.0 111.926 -177.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 75.4 mt -57.46 -55.88 18.5 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 C-N-CA 123.642 0.777 . . . . 0.0 110.131 174.035 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.81 -48.37 72.63 Favored Glycine 0 CA--C 1.525 0.686 0 N-CA-C 110.519 -1.032 . . . . 0.0 110.519 -177.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 7.4 mm -53.49 -48.57 57.8 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.303 0 C-N-CA 123.89 0.876 . . . . 0.0 109.975 174.278 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 40.3 t80 -56.47 -59.87 4.35 Favored 'General case' 0 CA--C 1.53 0.2 0 CA-C-N 118.533 0.606 . . . . 0.0 109.96 177.076 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 4.6 t-80 -52.29 -38.34 58.12 Favored 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 124.218 1.007 . . . . 0.0 111.583 -177.014 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 3.3 ttmp? -56.51 -29.29 61.67 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.276 1.03 . . . . 0.0 112.163 179.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 68.7 m-85 -110.8 -40.21 4.61 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.383 0.673 . . . . 0.0 112.262 -179.568 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 85.8 p -79.98 -46.34 16.84 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 119.462 1.028 . . . . 0.0 111.0 178.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -79.64 61.78 4.21 Favored Glycine 0 C--N 1.334 0.439 0 C-N-CA 124.955 1.264 . . . . 0.0 111.974 -169.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 21.5 mmmt -103.73 -52.74 2.91 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 107.639 -1.245 . . . . 0.0 107.639 171.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -169.24 176.62 5.12 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 126.068 1.747 . . . . 0.0 107.261 176.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 68.19 -149.3 49.92 Favored Glycine 0 CA--C 1.53 1.025 0 N-CA-C 112.219 -0.352 . . . . 0.0 112.219 174.166 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 62.8 t0 -78.99 68.81 5.03 Favored 'General case' 0 CA--C 1.531 0.215 0 C-N-CA 123.342 0.657 . . . . 0.0 109.917 -173.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 11.8 ptmm? -61.3 -7.85 3.29 Favored 'General case' 0 CA--C 1.534 0.363 0 N-CA-C 114.687 1.366 . . . . 0.0 114.687 -177.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 15.1 t-80 -75.95 -5.94 48.6 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 118.261 0.482 . . . . 0.0 110.193 170.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 19.2 p -135.46 165.11 26.26 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.192 1.397 . . . . 0.0 110.497 -179.287 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -160.74 167.1 27.55 Favored 'General case' 0 CA--C 1.529 0.155 0 C-N-CA 124.808 1.243 . . . . 0.0 108.219 168.553 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 6.5 t -121.12 -169.88 1.92 Allowed 'General case' 0 CA--C 1.537 0.459 0 CA-C-O 122.391 1.091 . . . . 0.0 113.575 -172.75 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 43.5 pttt -45.97 -55.76 6.4 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 127.879 2.472 . . . . 0.0 113.564 -169.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -56.3 -51.83 66.76 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 -178.019 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -57.98 -41.62 83.34 Favored 'General case' 0 N--CA 1.45 -0.431 0 C-N-CA 123.386 0.675 . . . . 0.0 110.891 179.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 42.3 mt -65.73 -48.76 70.83 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.496 0.589 . . . . 0.0 111.862 178.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 98.4 mttt -58.3 -46.15 86.66 Favored 'General case' 0 CA--C 1.532 0.267 0 O-C-N 121.786 -0.571 . . . . 0.0 109.805 176.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -58.05 -49.33 77.26 Favored 'General case' 0 C--O 1.219 -0.529 0 CA-C-O 118.889 -0.577 . . . . 0.0 110.42 174.575 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.1 mt -48.24 -52.3 21.67 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 119.513 1.051 . . . . 0.0 110.114 177.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 49.3 mt -56.56 -62.63 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.206 174.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 23.5 tt0 -49.2 -46.74 46.1 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.325 0.65 . . . . 0.0 112.599 -173.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.9 mmpt? -80.94 -53.92 6.03 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 125.592 1.557 . . . . 0.0 110.149 -171.319 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 47.8 mm-40 -95.22 -14.57 23.94 Favored 'General case' 0 CA--C 1.531 0.214 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -168.005 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 52.7 mt -121.12 81.17 1.74 Allowed 'General case' 0 C--N 1.337 0.034 0 C-N-CA 125.327 1.451 . . . . 0.0 108.059 173.3 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 64.9 p -79.62 47.64 0.86 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.104 0.961 . . . . 0.0 109.924 -176.181 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 22.8 mt -84.1 75.22 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 N-CA-C 107.656 -1.238 . . . . 0.0 107.656 -173.365 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -52.45 -46.95 57.75 Favored Glycine 0 CA--C 1.529 0.916 0 N-CA-C 110.084 -1.206 . . . . 0.0 110.084 171.198 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 6.1 m -70.89 67.62 0.4 Allowed 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 124.376 1.07 . . . . 0.0 110.166 171.583 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.61 ' HB3' HD11 ' A' ' 53' ' ' ILE . 63.3 mmtt -46.27 92.03 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 126.838 2.055 . . . . 0.0 112.47 -174.286 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 90.4 mt -62.6 112.78 2.63 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.103 0.961 . . . . 0.0 113.103 -170.246 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 67.86 -69.01 0.15 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 126.544 1.937 . . . . 0.0 114.086 167.23 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 15.6 p-10 -179.21 -38.92 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 125.724 1.609 . . . . 0.0 110.253 -170.376 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -36.2 -58.82 0.66 Allowed 'General case' 0 C--O 1.226 -0.17 0 C-N-CA 125.352 1.461 . . . . 0.0 113.593 -173.208 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -65.74 -39.87 91.55 Favored 'General case' 0 N--CA 1.454 -0.245 0 CA-C-O 120.771 0.319 . . . . 0.0 111.057 -173.076 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.68 HD12 ' H ' ' A' ' 53' ' ' ILE . 2.1 mp -61.14 -54.88 29.16 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.432 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 178.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 80.6 t -56.25 -45.31 81.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 C-N-CA 123.973 0.909 . . . . 0.0 110.285 -179.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.19 -52.83 63.73 Favored 'General case' 0 C--O 1.23 0.053 0 CA-C-N 118.846 0.748 . . . . 0.0 110.235 176.367 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 61.5 mt -55.0 -40.44 70.13 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 119.282 -0.39 . . . . 0.0 111.192 -179.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.25 -67.74 0.44 Allowed 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 118.523 0.601 . . . . 0.0 109.645 174.23 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -39.7 -41.3 1.06 Allowed 'General case' 0 C--N 1.34 0.152 0 C-N-CA 127.37 2.268 . . . . 0.0 112.097 -177.125 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -38.64 -49.96 1.58 Allowed 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 124.825 1.25 . . . . 0.0 112.19 175.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.7 pp -60.87 -41.56 96.19 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 118.333 0.515 . . . . 0.0 110.95 -176.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 16.5 m-20 -71.46 -42.72 67.82 Favored 'General case' 0 N--CA 1.457 -0.11 0 C-N-CA 123.619 0.768 . . . . 0.0 109.762 -178.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 14.5 ttm180 -59.1 -48.28 82.17 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.894 0.877 . . . . 0.0 110.208 178.464 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 8.4 m-80 -84.61 -47.9 10.05 Favored 'General case' 0 N--CA 1.456 -0.156 0 C-N-CA 122.547 0.339 . . . . 0.0 111.696 -171.02 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 57.9 mttp 54.64 -95.07 0.05 OUTLIER 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 124.141 0.977 . . . . 0.0 109.185 -167.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 16.6 m-20 -140.88 42.63 1.83 Allowed 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 119.039 0.836 . . . . 0.0 109.862 169.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -118.81 156.04 30.11 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 124.596 1.158 . . . . 0.0 108.853 172.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 24.9 mt-10 -87.22 130.03 34.73 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 169.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 11.0 m -79.55 143.3 12.73 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 170.206 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.7 p30 -83.38 167.81 17.18 Favored 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 122.78 0.432 . . . . 0.0 111.382 177.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 61.1 t80 -37.4 -59.18 0.78 Allowed 'General case' 0 CA--C 1.532 0.269 0 C-N-CA 124.508 1.123 . . . . 0.0 113.149 177.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 53.8 tp60 -64.9 -32.22 73.82 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 119.716 1.144 . . . . 0.0 111.153 -175.738 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -68.87 -40.27 79.38 Favored 'General case' 0 CA--C 1.533 0.304 0 O-C-N 121.537 -0.727 . . . . 0.0 110.539 176.672 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -56.14 -51.94 66.13 Favored 'General case' 0 CA--C 1.534 0.347 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 169.584 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.416 ' CG2' ' CG2' ' B' ' 74' ' ' ILE . 24.5 mm -56.78 -35.86 47.5 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.412 0 O-C-N 121.915 -0.491 . . . . 0.0 110.305 176.669 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 90.2 m -71.69 -34.52 69.73 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 119.217 0.917 . . . . 0.0 111.42 176.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -58.73 -51.93 67.86 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 119.106 0.866 . . . . 0.0 108.923 171.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 64.3 mt -59.96 -40.92 90.68 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 120.926 0.393 . . . . 0.0 111.322 174.159 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -59.7 -47.28 91.69 Favored Glycine 0 CA--C 1.525 0.657 0 N-CA-C 110.533 -1.027 . . . . 0.0 110.533 -179.772 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.03 -48.3 82.4 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.925 0.89 . . . . 0.0 109.694 176.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 8.9 tp -51.06 -60.27 3.28 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-O 121.981 0.896 . . . . 0.0 110.002 177.031 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -49.14 -54.93 14.02 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 125.518 1.527 . . . . 0.0 110.528 179.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 18.4 ttp -67.92 -33.6 75.0 Favored 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 123.772 0.829 . . . . 0.0 111.99 -174.199 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 90.9 mt -67.49 -58.42 6.29 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.346 0 CA-C-O 118.407 -0.806 . . . . 0.0 108.99 176.3 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.417 0.7 OUTLIER -70.8 -38.89 73.37 Favored 'General case' 0 C--N 1.346 0.436 0 C-N-CA 118.173 -1.411 . . . . 0.0 112.521 -174.542 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 29.7 m-80 -82.18 65.44 7.31 Favored 'General case' 0 N--CA 1.463 0.212 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 168.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 17.0 pt-20 -46.99 -32.58 3.99 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 124.517 1.127 . . . . 0.0 113.004 -172.104 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.94 -52.25 0.43 Allowed 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 125.85 1.66 . . . . 0.0 112.494 168.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 90.1 mt -61.45 -16.06 43.27 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 124.2 1.0 . . . . 0.0 113.455 -174.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -65.34 -20.97 66.63 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 119.031 0.832 . . . . 0.0 111.285 173.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.181 0 CA-C-O 116.824 -2.098 . . . . 0.0 112.504 178.006 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 96.3 mmm . . . . . 0 N--CA 1.474 0.76 0 CA-C-O 120.678 0.275 . . . . 0.0 110.288 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.08 68.89 3.29 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 121.983 -0.448 . . . . 0.0 110.222 176.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.7 m -51.26 159.86 1.02 Allowed Pre-proline 0 CA--C 1.537 0.468 0 C-N-CA 124.959 1.304 . . . . 0.0 110.688 173.625 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_exo -44.81 -49.87 9.09 Favored 'Trans proline' 0 N--CA 1.459 -0.52 0 C-N-CA 123.276 2.65 . . . . 0.0 113.401 -178.423 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.4 mt -57.95 -53.42 58.47 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 174.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -58.35 -40.44 82.22 Favored 'General case' 0 C--O 1.226 -0.158 0 CA-C-N 118.265 0.484 . . . . 0.0 110.029 -175.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -64.12 -50.69 67.27 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 124.462 1.105 . . . . 0.0 110.52 178.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -61.35 -46.12 91.54 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-O 121.602 0.715 . . . . 0.0 111.103 179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 64.9 mt -52.8 -53.01 23.13 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.235 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 170.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.76 -47.25 24.75 Favored Glycine 0 CA--C 1.527 0.796 0 C-N-CA 125.172 1.368 . . . . 0.0 111.784 176.082 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 1.4 mt -55.93 -55.34 33.82 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 117.606 0.703 . . . . 0.0 110.89 173.63 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -57.54 -43.66 84.55 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 118.864 0.757 . . . . 0.0 111.612 -179.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 89.1 mt -58.35 -52.75 55.32 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 C-N-CA 123.554 0.741 . . . . 0.0 110.69 174.414 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.0 -51.97 50.08 Favored Glycine 0 CA--C 1.523 0.543 0 N-CA-C 109.614 -1.394 . . . . 0.0 109.614 -178.026 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 9.1 mm -53.51 -49.93 52.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 C-N-CA 123.635 0.774 . . . . 0.0 110.474 175.377 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -51.76 -59.46 4.28 Favored 'General case' 0 C--N 1.339 0.134 0 CA-C-O 120.929 0.395 . . . . 0.0 110.059 178.321 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 67.9 t60 -55.04 -46.39 75.31 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.262 0.625 . . . . 0.0 110.635 -177.632 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -51.15 -28.83 11.89 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 125.546 1.539 . . . . 0.0 112.721 -179.423 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -132.27 44.6 2.87 Favored 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 119.006 0.821 . . . . 0.0 110.01 173.367 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 58.6 p -83.11 -102.31 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.305 0 CA-C-O 121.601 0.715 . . . . 0.0 111.769 -176.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -139.63 62.95 0.55 Allowed Glycine 0 C--N 1.333 0.374 0 N-CA-C 109.631 -1.388 . . . . 0.0 109.631 -168.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 30.1 mmtp -50.63 -33.36 21.97 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.716 1.207 . . . . 0.0 112.322 -174.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -62.46 -20.59 64.69 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 113.519 0.933 . . . . 0.0 113.519 179.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -177.15 -87.28 0.07 OUTLIER Glycine 0 CA--C 1.525 0.712 0 CA-C-N 118.545 0.612 . . . . 0.0 111.726 178.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -78.47 95.72 5.21 Favored 'General case' 0 C--N 1.338 0.091 0 CA-C-N 117.307 0.553 . . . . 0.0 109.556 -173.756 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 18.9 mttm -79.04 42.78 0.48 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.864 0.866 . . . . 0.0 112.168 -174.354 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 19.2 m80 -144.61 0.87 1.01 Allowed 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 127.349 2.26 . . . . 0.0 111.358 -173.065 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 3.4 p -128.84 169.85 14.08 Favored 'General case' 0 C--O 1.232 0.151 0 N-CA-C 106.775 -1.565 . . . . 0.0 106.775 169.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . 0.427 HD12 ' CG2' ' B' ' 68' ' ' VAL . 4.3 pp -159.34 -170.84 3.1 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.593 0.757 . . . . 0.0 109.619 175.247 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 14.4 m -149.69 178.82 8.52 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.125 -0.984 . . . . 0.0 111.357 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 19.4 pttm -37.23 -53.2 1.06 Allowed 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 126.576 1.95 . . . . 0.0 113.727 -179.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 23.1 ttmm -50.98 -50.35 58.39 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.782 0.833 . . . . 0.0 110.544 178.119 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 25.8 mp0 -67.39 -39.01 85.56 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-O 118.723 -0.656 . . . . 0.0 110.143 -178.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 78.0 mt -60.36 -46.43 89.98 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 119.373 0.988 . . . . 0.0 111.127 175.476 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -56.8 -51.43 68.96 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 175.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -55.64 -48.22 75.33 Favored 'General case' 0 C--O 1.22 -0.448 0 CA-C-N 117.861 0.3 . . . . 0.0 111.361 175.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 15.1 mt -51.77 -53.52 38.84 Favored 'General case' 0 C--N 1.331 -0.218 0 O-C-N 121.504 -0.748 . . . . 0.0 109.776 -178.739 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 1.4 mp -57.13 -58.14 7.13 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 N-CA-C 110.287 -0.264 . . . . 0.0 110.287 174.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 62.0 tt0 -53.5 -47.77 69.58 Favored 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.574 0.75 . . . . 0.0 112.037 -172.085 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 10.7 mmpt? -82.66 -49.39 9.86 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 125.204 1.402 . . . . 0.0 110.211 -173.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 52.7 mm-40 -98.98 -2.47 37.29 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-O 117.248 -1.358 . . . . 0.0 114.424 -167.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 72.1 mt -126.03 90.04 3.13 Favored 'General case' 0 N--CA 1.462 0.175 0 CA-C-N 120.673 1.579 . . . . 0.0 110.214 169.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 37.9 p -73.79 65.87 1.06 Allowed 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.201 1.0 . . . . 0.0 108.302 169.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 10.8 tt -78.24 59.2 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 C-N-CA 124.96 1.304 . . . . 0.0 111.725 -169.202 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 63.94 -76.95 0.05 OUTLIER Glycine 0 CA--C 1.526 0.754 0 C-N-CA 125.882 1.706 . . . . 0.0 111.312 -178.077 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 36.7 m -163.63 56.69 0.17 Allowed 'General case' 0 C--N 1.332 -0.179 0 C-N-CA 126.659 1.984 . . . . 0.0 107.24 176.342 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp 55.67 51.28 12.77 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 124.128 0.971 . . . . 0.0 110.204 -173.381 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 4.3 pp -72.02 138.35 47.86 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 119.684 -0.806 . . . . 0.0 110.069 174.616 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 72.75 119.7 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.677 1.991 . . . . 0.0 113.003 171.635 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -42.23 -38.98 1.92 Allowed 'General case' 0 N--CA 1.464 0.243 0 C-N-CA 127.12 2.168 . . . . 0.0 114.959 -169.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.94 -60.58 0.16 Allowed 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 125.851 1.661 . . . . 0.0 113.524 -178.362 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -68.55 -34.57 76.08 Favored 'General case' 0 N--CA 1.457 -0.111 0 N-CA-C 111.781 0.289 . . . . 0.0 111.781 -174.085 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 53' ' ' ILE . . . . . 0.509 ' N ' HD12 ' B' ' 53' ' ' ILE . 1.2 mp -65.87 -52.54 48.25 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.511 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 -178.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 80.3 t -54.31 -45.49 68.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 C-N-CA 123.699 0.799 . . . . 0.0 110.093 174.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.41 -50.64 72.36 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 118.482 0.583 . . . . 0.0 110.926 177.263 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 54.4 mt -56.19 -39.87 73.09 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 123.202 0.601 . . . . 0.0 111.284 178.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -66.44 -64.95 0.75 Allowed 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 118.762 0.71 . . . . 0.0 109.085 174.186 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -40.51 -42.51 1.66 Allowed 'General case' 0 N--CA 1.463 0.209 0 C-N-CA 126.637 1.975 . . . . 0.0 111.943 -178.147 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -38.13 -48.65 1.26 Allowed 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 126.001 1.72 . . . . 0.0 112.634 177.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.6 pp -63.11 -42.23 99.51 Favored 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 121.078 -0.249 . . . . 0.0 110.833 -176.288 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -73.59 -37.76 65.34 Favored 'General case' 0 N--CA 1.457 -0.085 0 C-N-CA 123.791 0.836 . . . . 0.0 110.257 -178.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 15.6 ttm180 -58.38 -48.5 80.4 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 123.325 0.65 . . . . 0.0 109.614 175.092 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 4.8 m-80 -81.7 -66.61 0.87 Allowed 'General case' 0 C--O 1.232 0.166 0 C-N-CA 122.222 0.209 . . . . 0.0 111.311 -174.412 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 23.1 mtmm 61.84 -75.89 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.31 0 C-N-CA 125.733 1.613 . . . . 0.0 108.76 -167.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -138.49 -12.38 1.35 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.556 1.542 . . . . 0.0 112.087 175.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.6 104.26 8.03 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 118.997 0.817 . . . . 0.0 109.979 -173.128 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 26.9 mp0 -49.8 124.68 10.22 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 123.647 0.779 . . . . 0.0 109.368 169.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . 0.427 ' CG2' HD12 ' B' ' 29' ' ' LEU . 29.5 m -85.91 155.86 3.41 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.458 0 CA-C-O 121.33 0.586 . . . . 0.0 109.896 -177.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 16.7 p30 -105.17 -176.79 3.18 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 126.184 1.794 . . . . 0.0 110.928 179.426 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -52.93 -63.48 1.13 Allowed 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 123.637 0.775 . . . . 0.0 112.183 -179.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -62.76 -32.68 73.87 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 119.703 1.138 . . . . 0.0 111.327 -175.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -59.16 -50.52 73.72 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 119.525 1.057 . . . . 0.0 110.666 173.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -53.9 -49.75 67.9 Favored 'General case' 0 CA--C 1.536 0.412 0 O-C-N 121.957 -0.464 . . . . 0.0 110.227 173.245 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 0.416 ' CG2' ' CG2' ' A' ' 74' ' ' ILE . 26.2 mm -60.85 -27.18 40.65 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 O-C-N 121.934 -0.479 . . . . 0.0 111.18 177.343 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 83.6 m -76.12 -33.94 59.46 Favored 'General case' 0 C--N 1.333 -0.114 0 O-C-N 120.898 -1.126 . . . . 0.0 110.154 173.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -57.34 -57.98 10.26 Favored 'General case' 0 CA--C 1.532 0.286 0 N-CA-C 108.663 -0.866 . . . . 0.0 108.663 169.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 48.4 mt -61.37 -40.31 93.84 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-O 120.943 0.401 . . . . 0.0 111.996 179.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.3 -47.06 65.81 Favored Glycine 0 CA--C 1.524 0.651 0 N-CA-C 110.721 -0.952 . . . . 0.0 110.721 -176.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.28 -44.58 87.54 Favored 'General case' 0 CA--C 1.532 0.286 0 O-C-N 121.867 -0.784 . . . . 0.0 110.174 176.228 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 13.9 tp -48.29 -56.83 7.04 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 123.604 0.761 . . . . 0.0 110.145 172.55 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.05 -55.0 23.39 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 124.474 1.11 . . . . 0.0 110.612 175.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 39.5 ttm -51.33 -47.13 62.79 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 124.243 1.017 . . . . 0.0 110.982 -178.136 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 60.6 mt -68.8 -61.21 1.78 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-O 118.321 -0.847 . . . . 0.0 110.566 178.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.39 0.3 OUTLIER -65.7 -44.47 86.06 Favored 'General case' 0 C--N 1.346 0.434 0 C-N-CA 117.891 -1.524 . . . . 0.0 112.02 -171.331 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 64.7 m-80 -82.94 62.57 6.57 Favored 'General case' 0 C--O 1.228 -0.047 0 N-CA-C 107.896 -1.15 . . . . 0.0 107.896 169.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -49.21 -30.07 6.49 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.196 1.398 . . . . 0.0 112.268 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -40.37 -37.94 0.74 Allowed 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 125.795 1.638 . . . . 0.0 113.138 169.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 28.5 mt -53.42 -38.84 63.86 Favored 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 123.788 0.835 . . . . 0.0 111.988 176.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 65.1 mttm -75.32 54.41 0.72 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 124.342 1.057 . . . . 0.0 111.4 -175.385 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.09 0 CA-C-O 117.729 -1.595 . . . . 0.0 109.965 178.807 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.3 mpp? . . . . . 0 N--CA 1.474 0.746 0 CA-C-O 120.74 0.305 . . . . 0.0 110.852 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -76.56 70.96 3.15 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 123.141 0.577 . . . . 0.0 110.75 -176.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.1 m -57.39 165.78 1.95 Allowed Pre-proline 0 CA--C 1.54 0.594 0 C-N-CA 124.915 1.286 . . . . 0.0 111.885 178.039 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_exo -47.19 -47.43 17.11 Favored 'Trans proline' 0 N--CA 1.458 -0.578 0 C-N-CA 123.575 2.85 . . . . 0.0 113.376 178.735 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.7 mt -55.42 -49.62 71.93 Favored 'General case' 0 C--N 1.341 0.204 0 CA-C-N 118.01 0.368 . . . . 0.0 111.495 173.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -61.52 -41.31 97.13 Favored 'General case' 0 N--CA 1.456 -0.167 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 -176.391 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 17.0 tt0 -60.48 -51.78 67.99 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.33 0.652 . . . . 0.0 110.831 175.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.06 -45.83 90.35 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 123.527 0.731 . . . . 0.0 111.227 -177.296 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 66.7 mt -53.1 -53.5 22.16 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 N-CA-C 108.074 -1.084 . . . . 0.0 108.074 169.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -45.78 -47.83 13.49 Favored Glycine 0 CA--C 1.528 0.902 0 C-N-CA 125.188 1.375 . . . . 0.0 112.156 175.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.0 mt -54.95 -56.48 19.19 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 117.733 0.766 . . . . 0.0 110.861 173.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.4 mp -58.17 -43.95 87.73 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 121.611 -0.681 . . . . 0.0 111.601 -179.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 60.7 mt -55.41 -56.04 13.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.18 0 C-N-CA 123.727 0.811 . . . . 0.0 109.975 174.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.01 -49.63 61.92 Favored Glycine 0 CA--C 1.523 0.56 0 N-CA-C 110.268 -1.133 . . . . 0.0 110.268 -177.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 8.8 mm -53.34 -48.5 56.16 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 C-N-CA 123.242 0.617 . . . . 0.0 110.454 176.52 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 67.8 t80 -56.54 -60.93 2.82 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 121.684 0.754 . . . . 0.0 109.892 175.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -53.76 -37.39 63.36 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.854 1.262 . . . . 0.0 111.616 -172.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.5 tttp -50.28 -36.92 33.59 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.2 1.0 . . . . 0.0 111.855 177.151 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 46.5 m-85 -102.28 -52.14 3.2 Favored 'General case' 0 CA--C 1.528 0.111 0 C-N-CA 123.064 0.545 . . . . 0.0 109.682 -179.782 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.6 m -59.41 -37.77 78.89 Favored 'General case' 0 N--CA 1.453 -0.292 0 O-C-N 121.759 -0.588 . . . . 0.0 112.431 -175.549 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -72.89 63.72 1.58 Allowed Glycine 0 C--N 1.339 0.721 0 C-N-CA 124.394 0.997 . . . . 0.0 113.055 -172.452 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.5 pttp -170.12 -33.69 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.728 1.611 . . . . 0.0 111.196 174.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -76.72 38.63 0.2 Allowed 'General case' 0 CA--C 1.539 0.558 0 CA-C-N 119.647 1.112 . . . . 0.0 113.693 -173.841 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 66.01 -75.89 0.12 Allowed Glycine 0 CA--C 1.53 0.998 0 O-C-N 121.399 -0.813 . . . . 0.0 111.203 -175.597 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 67.1 t0 -78.71 78.57 5.15 Favored 'General case' 0 N--CA 1.454 -0.243 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 179.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 13.0 ptmm? -60.79 -9.93 4.76 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 -178.694 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 26.5 t-80 -78.62 -11.58 59.98 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.844 0.747 . . . . 0.0 111.349 173.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 4.9 p -122.35 166.43 14.71 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 125.603 1.561 . . . . 0.0 111.431 178.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -151.62 164.34 37.1 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 124.088 0.955 . . . . 0.0 109.079 168.12 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 84.3 p -87.04 165.28 15.93 Favored 'General case' 0 N--CA 1.455 -0.22 0 C-N-CA 124.66 1.184 . . . . 0.0 113.125 -172.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 24.2 pttm -48.83 -47.34 42.54 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 115.358 -0.837 . . . . 0.0 110.395 168.075 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -57.28 -53.28 59.88 Favored 'General case' 0 N--CA 1.445 -0.69 0 C-N-CA 124.542 1.137 . . . . 0.0 109.37 178.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -56.62 -43.65 80.42 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 118.208 -0.901 . . . . 0.0 111.812 178.146 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 6.8 mt -60.4 -52.29 65.84 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 119.881 1.219 . . . . 0.0 111.597 175.549 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 56.9 mtmt -58.48 -38.21 77.12 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 122.374 0.27 . . . . 0.0 110.803 -178.565 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -60.62 -70.39 0.18 Allowed 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 168.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.3 mt -32.16 -60.23 0.28 Allowed 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 126.175 1.79 . . . . 0.0 112.341 -176.397 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 15.4 tt -56.34 -54.17 31.21 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 O-C-N 123.464 0.477 . . . . 0.0 109.874 -173.592 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 17.4 tt0 -69.01 -40.46 78.66 Favored 'General case' 0 CA--C 1.533 0.325 0 O-C-N 121.851 -0.531 . . . . 0.0 111.733 -176.389 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.8 mmpt? -60.93 -54.26 47.14 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 123.692 0.797 . . . . 0.0 109.691 -178.841 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 65.8 mm-40 -84.68 -49.96 8.05 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.399 -169.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 98.4 mt -78.0 73.88 4.55 Favored 'General case' 0 C--N 1.339 0.128 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 170.428 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 21.0 p -50.5 -43.97 55.85 Favored 'General case' 0 N--CA 1.452 -0.343 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 170.029 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . 0.271 4.3 tt 52.06 -56.38 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.537 0.443 0 C-N-CA 130.195 3.398 . . . . 0.0 117.444 167.681 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 135.99 -162.42 24.99 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 107.017 -2.433 . . . . 0.0 107.017 -170.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 3.7 m -74.02 60.6 0.78 Allowed 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 123.988 0.915 . . . . 0.0 112.84 -174.35 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 61.2 mttp 49.26 61.74 2.98 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.726 1.211 . . . . 0.0 110.091 178.517 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 26.2 mt -44.61 -43.69 8.36 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 115.608 1.707 . . . . 0.0 115.608 -168.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 44.3 tt0 -147.51 140.3 24.87 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 118.473 0.579 . . . . 0.0 109.935 -168.406 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -36.68 -44.74 0.48 Allowed 'General case' 0 N--CA 1.462 0.165 0 C-N-CA 128.47 2.708 . . . . 0.0 113.748 -169.288 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -36.87 -51.16 0.89 Allowed 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 124.661 1.184 . . . . 0.0 112.799 179.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -65.95 -39.32 90.34 Favored 'General case' 0 CA--C 1.53 0.193 0 CA-C-O 121.256 0.55 . . . . 0.0 111.103 -175.195 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.509 ' N ' HD12 ' A' ' 53' ' ' ILE . 1.1 mp -65.36 -51.98 57.71 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.578 0 N-CA-C 106.904 -1.517 . . . . 0.0 106.904 -179.708 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 84.6 t -56.69 -44.17 80.76 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.317 0 C-N-CA 123.892 0.877 . . . . 0.0 110.324 178.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -56.65 -53.45 57.5 Favored 'General case' 0 CA--C 1.529 0.145 0 CA-C-N 118.65 0.659 . . . . 0.0 110.195 173.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 40.8 mt -53.13 -44.3 67.61 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-O 119.204 -0.427 . . . . 0.0 111.521 178.662 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 26.2 mmt -64.89 -57.82 7.79 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-O 121.797 0.808 . . . . 0.0 109.885 177.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -56.29 -32.94 65.05 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 125.272 1.429 . . . . 0.0 111.835 -173.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -38.59 -47.66 1.34 Allowed 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 125.314 1.446 . . . . 0.0 112.397 -178.191 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -55.83 -48.33 75.65 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 122.348 0.259 . . . . 0.0 110.708 -178.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -67.61 -45.34 75.72 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 123.139 0.576 . . . . 0.0 110.198 176.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 14.2 ttt85 -53.46 -43.5 68.16 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.954 0.902 . . . . 0.0 111.014 -178.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 16.3 m-80 -84.8 -5.54 59.33 Favored 'General case' 0 N--CA 1.462 0.138 0 C-N-CA 123.95 0.9 . . . . 0.0 112.401 177.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 93.0 mttt 45.56 48.62 11.12 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.605 1.162 . . . . 0.0 110.023 -168.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 56.91 26.74 12.08 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 126.411 1.884 . . . . 0.0 113.196 -178.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 29.5 mt-30 -137.83 -100.69 0.19 Allowed 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.952 0.901 . . . . 0.0 111.76 179.638 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 7.5 mp0 -135.61 167.03 21.86 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 125.659 1.584 . . . . 0.0 111.107 -168.31 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 15.5 m -137.03 156.31 34.13 Favored 'Isoleucine or valine' 0 C--O 1.235 0.303 0 C-N-CA 125.37 1.468 . . . . 0.0 108.844 168.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -88.67 168.48 12.48 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 124.016 0.926 . . . . 0.0 111.622 175.142 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -36.63 -62.0 0.49 Allowed 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 124.512 1.125 . . . . 0.0 113.447 172.79 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 43.7 tp60 -63.29 -34.09 76.94 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 120.851 -1.156 . . . . 0.0 111.235 -174.28 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -66.28 -41.4 89.87 Favored 'General case' 0 CA--C 1.535 0.382 0 O-C-N 121.366 -0.834 . . . . 0.0 110.371 175.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -54.49 -49.27 70.53 Favored 'General case' 0 CA--C 1.536 0.435 0 O-C-N 121.614 -0.678 . . . . 0.0 109.651 169.74 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.407 ' CG2' ' CG2' ' B' ' 74' ' ' ILE . 29.6 mm -58.65 -32.8 47.09 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 O-C-N 121.764 -0.585 . . . . 0.0 110.676 175.3 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 25.5 m -72.13 -30.97 65.58 Favored 'General case' 0 CA--C 1.534 0.345 0 O-C-N 121.232 -0.917 . . . . 0.0 111.253 175.363 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -61.77 -56.48 19.05 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 121.083 -1.011 . . . . 0.0 108.739 171.76 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 49.2 mt -61.49 -41.97 98.08 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 120.875 0.369 . . . . 0.0 111.418 178.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.8 -46.36 89.88 Favored Glycine 0 CA--C 1.523 0.587 0 N-CA-C 110.663 -0.975 . . . . 0.0 110.663 -178.215 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.97 -45.91 92.84 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 117.97 0.885 . . . . 0.0 110.423 174.758 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 16.8 tp -51.73 -55.74 17.85 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 121.18 0.514 . . . . 0.0 109.807 176.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.83 -56.14 15.74 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 124.75 1.22 . . . . 0.0 110.163 179.261 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 54.5 ttm -50.43 -52.6 36.32 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 125.6 1.56 . . . . 0.0 110.574 -179.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 71.3 mt -64.84 -64.41 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.346 0 CA-C-O 118.748 -0.644 . . . . 0.0 109.403 -177.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.448 0.1 OUTLIER -67.47 -37.1 82.39 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 118.314 -1.354 . . . . 0.0 113.253 -169.245 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 24.1 m-80 -81.51 68.79 7.98 Favored 'General case' 0 N--CA 1.461 0.101 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 170.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -37.62 -46.64 0.88 Allowed 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.503 1.521 . . . . 0.0 111.619 -176.074 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -30.93 -53.51 0.19 Allowed 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 126.756 2.022 . . . . 0.0 113.506 171.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 18.7 mt -46.98 -40.37 14.3 Favored 'General case' 0 C--O 1.224 -0.261 0 C-N-CA 123.996 0.919 . . . . 0.0 111.95 -178.293 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 53.4 mtmt -65.76 -15.64 63.03 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -173.743 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.052 0 CA-C-O 116.878 -2.068 . . . . 0.0 110.609 174.025 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 55.5 ttp . . . . . 0 N--CA 1.473 0.698 0 CA-C-O 120.636 0.255 . . . . 0.0 110.395 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -75.25 74.69 2.38 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-O 120.794 0.33 . . . . 0.0 110.621 -178.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 13.0 m -50.74 156.37 1.63 Allowed Pre-proline 0 CA--C 1.542 0.656 0 C-N-CA 123.56 0.744 . . . . 0.0 111.008 170.668 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -47.11 -51.5 9.29 Favored 'Trans proline' 0 C--N 1.346 0.44 0 C-N-CA 123.23 2.62 . . . . 0.0 113.465 -178.01 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 4.9 mt -52.79 -46.89 67.84 Favored 'General case' 0 C--O 1.227 -0.124 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 172.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -63.48 -40.62 97.58 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 118.16 0.436 . . . . 0.0 110.1 -177.045 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 14.1 tp60 -63.4 -46.3 87.07 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 122.438 0.295 . . . . 0.0 110.7 175.47 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.76 -47.02 85.33 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 121.357 0.599 . . . . 0.0 110.872 -179.157 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 65.1 mt -53.15 -53.39 23.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 169.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.29 -44.8 21.11 Favored Glycine 0 CA--C 1.527 0.822 0 C-N-CA 125.588 1.566 . . . . 0.0 112.02 176.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.6 mt -57.27 -55.57 33.11 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 117.569 0.685 . . . . 0.0 110.587 173.612 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.9 mp -57.86 -41.99 83.58 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 118.996 0.816 . . . . 0.0 111.647 179.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 66.7 mt -57.13 -56.37 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 C-N-CA 123.841 0.856 . . . . 0.0 110.736 173.448 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.07 -50.55 58.62 Favored Glycine 0 CA--C 1.521 0.444 0 N-CA-C 109.751 -1.34 . . . . 0.0 109.751 -177.206 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 12.5 mm -52.1 -49.06 41.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 C-N-CA 123.47 0.708 . . . . 0.0 110.474 174.341 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 48.7 t80 -55.49 -65.36 0.6 Allowed 'General case' 0 CA--C 1.53 0.185 0 CA-C-N 118.31 0.505 . . . . 0.0 110.18 178.335 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 3.0 m-70 -58.92 -30.67 68.01 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 118.205 -0.902 . . . . 0.0 112.707 -174.398 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 65.3 tttp -49.13 -36.71 19.75 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 119.301 0.955 . . . . 0.0 111.293 173.33 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 67.4 m-85 -100.68 -56.73 2.26 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 122.935 0.494 . . . . 0.0 110.169 177.459 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.4 m -51.76 -39.77 59.12 Favored 'General case' 0 CA--C 1.533 0.326 0 CA-C-N 118.832 0.742 . . . . 0.0 111.589 -176.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -33.96 -56.33 0.67 Allowed Glycine 0 C--N 1.338 0.686 0 C-N-CA 125.606 1.574 . . . . 0.0 113.275 173.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.3 -7.61 43.87 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 114.581 1.326 . . . . 0.0 114.581 -168.518 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -104.36 14.84 29.44 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 119.472 1.033 . . . . 0.0 112.269 173.554 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 77.89 -61.44 3.71 Favored Glycine 0 CA--C 1.527 0.798 0 O-C-N 121.621 -0.675 . . . . 0.0 112.508 168.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 61.7 t0 -78.28 63.21 3.13 Favored 'General case' 0 C--O 1.232 0.174 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 175.195 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 21.5 pttp -70.98 4.79 2.38 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 125.261 1.424 . . . . 0.0 113.789 -169.218 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 23.6 t-160 -76.92 -16.14 59.46 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 124.55 1.14 . . . . 0.0 109.055 167.5 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 32.2 p -133.48 160.83 36.25 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 125.177 1.391 . . . . 0.0 111.429 -174.208 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -161.34 177.72 9.88 Favored 'General case' 0 CA--C 1.533 0.327 0 C-N-CA 124.831 1.252 . . . . 0.0 108.668 168.477 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.4 t -131.83 -169.44 2.2 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 120.259 1.39 . . . . 0.0 112.241 -175.112 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 19.2 pttp -42.25 -53.54 4.07 Favored 'General case' 0 C--O 1.233 0.222 0 C-N-CA 127.877 2.471 . . . . 0.0 113.227 -174.062 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 3.2 tppp? -55.67 -53.41 56.94 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 123.517 0.727 . . . . 0.0 109.568 -178.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 28.2 mp0 -64.44 -38.04 89.64 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.289 -176.65 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 43.6 mt -61.9 -52.59 63.46 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 118.542 0.61 . . . . 0.0 111.228 177.591 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -61.88 -43.78 98.14 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.545 -0.722 . . . . 0.0 110.506 178.413 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 71.6 tt0 -53.24 -51.96 60.51 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 123.758 0.823 . . . . 0.0 110.363 174.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 7.9 mt -49.49 -56.95 8.01 Favored 'General case' 0 N--CA 1.457 -0.121 0 C-N-CA 124.552 1.141 . . . . 0.0 110.13 177.391 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 33.7 mm -53.92 -58.99 2.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 177.503 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 11.1 tp-100 -54.31 -47.06 72.88 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 123.272 0.629 . . . . 0.0 112.425 -172.166 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -78.1 -56.28 4.6 Favored 'General case' 0 CA--C 1.532 0.254 0 O-C-N 122.096 -0.377 . . . . 0.0 110.745 -178.316 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -82.59 -20.55 36.26 Favored 'General case' 0 N--CA 1.455 -0.22 0 N-CA-C 113.815 1.043 . . . . 0.0 113.815 -167.163 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 76.1 mt -110.76 90.13 3.24 Favored 'General case' 0 N--CA 1.457 -0.115 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 168.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 64.2 p -76.36 55.89 1.03 Allowed 'General case' 0 N--CA 1.452 -0.325 0 C-N-CA 124.255 1.022 . . . . 0.0 109.259 178.057 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 50.5 mt -100.33 73.07 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.478 0 N-CA-C 106.454 -1.684 . . . . 0.0 106.454 -178.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -59.5 -48.79 84.29 Favored Glycine 0 CA--C 1.528 0.902 0 N-CA-C 109.184 -1.567 . . . . 0.0 109.184 172.282 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 23.2 p -71.28 74.38 0.71 Allowed 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 124.128 0.971 . . . . 0.0 108.674 169.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . 0.522 ' HB3' HD11 ' B' ' 53' ' ' ILE . 47.6 mttp -51.01 95.17 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 125.487 1.515 . . . . 0.0 111.113 179.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 95.5 mt -42.27 -54.04 3.88 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 126.489 1.916 . . . . 0.0 112.973 -171.145 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -163.27 160.14 23.51 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 106.723 -1.584 . . . . 0.0 106.723 -172.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -36.62 -41.66 0.32 Allowed 'General case' 0 C--O 1.226 -0.136 0 C-N-CA 127.932 2.493 . . . . 0.0 114.184 -171.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.4 -57.41 0.15 Allowed 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 126.027 1.731 . . . . 0.0 113.906 -178.896 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -67.4 -41.91 84.15 Favored 'General case' 0 N--CA 1.457 -0.083 0 CA-C-O 120.849 0.356 . . . . 0.0 111.166 -174.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 53' ' ' ILE . . . . . 0.612 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.4 mp -60.65 -52.08 65.64 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.487 0 N-CA-C 107.066 -1.457 . . . . 0.0 107.066 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 78.4 t -54.49 -53.37 31.52 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.509 0 C-N-CA 123.914 0.886 . . . . 0.0 109.428 177.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -50.28 -55.17 16.57 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 119.317 0.962 . . . . 0.0 110.927 176.932 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 68.1 mt -54.67 -43.47 72.45 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 122.593 0.357 . . . . 0.0 111.655 -175.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -75.55 -59.67 2.65 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 118.097 0.408 . . . . 0.0 111.09 177.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -40.88 -43.71 2.12 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 126.458 1.903 . . . . 0.0 111.447 178.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -38.52 -49.01 1.47 Allowed 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 125.046 1.338 . . . . 0.0 112.547 176.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -58.6 -47.02 85.72 Favored 'General case' 0 CA--C 1.53 0.175 0 N-CA-C 109.98 -0.378 . . . . 0.0 109.98 -176.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -67.91 -44.04 77.85 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 122.736 0.415 . . . . 0.0 110.724 178.44 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 11.2 ttp180 -56.55 -46.28 80.79 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 123.664 0.786 . . . . 0.0 110.095 -178.657 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 5.5 m-80 -84.51 -54.08 4.99 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 122.879 0.472 . . . . 0.0 111.179 -174.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp 64.19 -80.67 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 107.509 -1.293 . . . . 0.0 107.509 -165.542 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -148.3 21.61 1.07 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 124.958 1.303 . . . . 0.0 110.798 169.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -77.51 143.45 38.43 Favored 'General case' 0 N--CA 1.452 -0.374 0 O-C-N 121.611 -0.681 . . . . 0.0 109.466 178.243 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 67.9 mm-40 -89.44 107.97 19.38 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 106.237 -1.764 . . . . 0.0 106.237 168.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 12.2 m -78.17 140.22 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.374 0 N-CA-C 107.795 -1.187 . . . . 0.0 107.795 -179.181 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -81.36 167.06 19.88 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 120.551 0.215 . . . . 0.0 110.71 175.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -32.37 -61.04 0.27 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.978 1.311 . . . . 0.0 112.902 171.589 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 37.8 tp60 -61.35 -33.3 73.39 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 119.604 1.093 . . . . 0.0 112.128 -174.726 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -72.53 -38.77 67.94 Favored 'General case' 0 C--O 1.236 0.35 0 O-C-N 121.338 -0.851 . . . . 0.0 110.16 177.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -56.14 -50.74 70.27 Favored 'General case' 0 CA--C 1.536 0.409 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 169.675 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 0.407 ' CG2' ' CG2' ' A' ' 74' ' ' ILE . 25.8 mm -55.82 -41.17 65.31 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.272 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 175.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 58.4 m -60.03 -37.95 81.28 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-N 118.976 0.807 . . . . 0.0 110.94 176.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 20.7 t80 -57.09 -53.97 52.1 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 121.726 -0.608 . . . . 0.0 109.842 174.223 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 60.2 mt -62.98 -38.27 90.45 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 120.979 0.419 . . . . 0.0 111.893 179.113 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -67.65 -43.51 84.99 Favored Glycine 0 CA--C 1.522 0.508 0 N-CA-C 110.0 -1.24 . . . . 0.0 110.0 -178.414 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -60.74 -48.31 82.37 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 117.553 0.676 . . . . 0.0 109.881 173.438 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 9.1 tp -50.39 -57.7 7.37 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-O 121.429 0.633 . . . . 0.0 110.054 175.426 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.5 -56.64 10.71 Favored 'General case' 0 N--CA 1.449 -0.494 0 C-N-CA 124.877 1.271 . . . . 0.0 110.433 179.018 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 43.8 ttm -52.57 -49.66 64.51 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 125.555 1.542 . . . . 0.0 110.665 -179.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 58.3 mt -69.84 -50.02 52.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-O 117.894 -1.051 . . . . 0.0 110.262 -172.503 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.451 1.2 p90 -76.52 -37.93 55.94 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 120.166 1.348 . . . . 0.0 113.381 -178.573 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 25.2 m-80 -81.29 67.4 7.21 Favored 'General case' 0 N--CA 1.463 0.203 0 O-C-N 121.102 -0.999 . . . . 0.0 108.692 173.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -41.54 -42.03 2.29 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 125.259 1.424 . . . . 0.0 111.464 179.303 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.5 -47.67 0.23 Allowed 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 126.192 1.797 . . . . 0.0 113.575 172.063 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 47.7 mt -56.1 -51.75 66.77 Favored 'General case' 0 N--CA 1.457 -0.082 0 C-N-CA 122.807 0.443 . . . . 0.0 110.832 178.431 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -63.55 -43.98 95.5 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 179.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.159 0 CA-C-O 117.257 -1.857 . . . . 0.0 110.466 169.838 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.473 0.676 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -71.57 78.22 0.8 Allowed 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 122.72 0.408 . . . . 0.0 110.533 -179.129 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.1 m -51.13 157.62 1.46 Allowed Pre-proline 0 CA--C 1.538 0.488 0 C-N-CA 125.031 1.332 . . . . 0.0 111.427 176.272 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_exo -46.45 -49.64 11.53 Favored 'Trans proline' 0 N--CA 1.459 -0.518 0 C-N-CA 123.28 2.653 . . . . 0.0 112.929 -179.188 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.0 mt -58.54 -45.78 88.17 Favored 'General case' 0 C--O 1.225 -0.217 0 N-CA-C 111.832 0.308 . . . . 0.0 111.832 175.489 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -61.34 -43.26 99.16 Favored 'General case' 0 C--O 1.226 -0.163 0 CA-C-N 118.3 0.5 . . . . 0.0 109.656 -177.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -60.71 -49.78 76.13 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.518 0.727 . . . . 0.0 110.573 176.413 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.47 -45.89 90.96 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.276 0.63 . . . . 0.0 111.388 -178.349 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 65.5 mt -53.78 -51.64 42.29 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 170.463 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.73 -48.84 17.59 Favored Glycine 0 CA--C 1.527 0.81 0 C-N-CA 124.733 1.159 . . . . 0.0 112.013 174.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.1 mt -55.51 -56.49 19.66 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 117.749 0.775 . . . . 0.0 111.062 174.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.23 -42.74 86.97 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 118.586 0.63 . . . . 0.0 111.451 -178.574 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 79.0 mt -58.24 -52.34 60.03 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.186 0 C-N-CA 123.578 0.751 . . . . 0.0 110.586 173.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.72 -50.65 59.7 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.069 -1.212 . . . . 0.0 110.069 -178.378 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 8.6 mm -52.94 -48.82 50.98 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 C-N-CA 123.306 0.642 . . . . 0.0 110.093 175.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -55.57 -59.01 5.43 Favored 'General case' 0 CA--C 1.531 0.224 0 CA-C-O 120.71 0.291 . . . . 0.0 110.527 177.634 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 5.6 t-80 -55.36 -39.83 70.55 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 124.252 1.021 . . . . 0.0 111.061 -175.544 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.4 tttm -48.25 -34.49 10.39 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.653 0.781 . . . . 0.0 112.064 -178.37 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 48.3 m-85 -107.16 -53.59 2.59 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.41 0.684 . . . . 0.0 109.793 178.1 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.8 m -60.68 -39.31 87.97 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.894 0.878 . . . . 0.0 112.267 -172.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -77.15 55.6 3.59 Favored Glycine 0 CA--C 1.526 0.724 0 C-N-CA 123.803 0.716 . . . . 0.0 112.066 -171.024 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.0 mtmp? -150.07 -45.17 0.13 Allowed 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 125.955 1.702 . . . . 0.0 110.614 -176.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 4.5 pt-20 -75.18 42.38 0.19 Allowed 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 114.373 1.249 . . . . 0.0 114.373 -169.133 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 69.57 -71.21 0.51 Allowed Glycine 0 CA--C 1.528 0.858 0 N-CA-C 110.623 -0.991 . . . . 0.0 110.623 -177.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 66.2 t0 -78.09 81.22 4.49 Favored 'General case' 0 N--CA 1.451 -0.424 0 N-CA-C 107.428 -1.323 . . . . 0.0 107.428 173.145 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 25.3 mtpp -46.9 -27.46 1.26 Allowed 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.472 1.509 . . . . 0.0 112.99 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 4.8 m80 -82.34 -5.18 58.43 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.62 1.568 . . . . 0.0 112.445 -171.469 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 6.9 p -126.91 164.5 21.31 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.753 1.221 . . . . 0.0 110.84 -178.694 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -154.44 174.63 14.62 Favored 'General case' 0 CA--C 1.528 0.127 0 C-N-CA 124.342 1.057 . . . . 0.0 109.258 169.608 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 78.6 p -127.0 168.06 15.06 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 124.52 1.128 . . . . 0.0 112.831 -171.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 8.3 pttp -32.26 -61.34 0.26 Allowed 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 127.515 2.326 . . . . 0.0 113.921 177.47 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 20.5 tptp -54.66 -47.25 73.78 Favored 'General case' 0 N--CA 1.449 -0.496 0 O-C-N 121.881 -0.512 . . . . 0.0 111.368 -179.27 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -61.81 -40.99 97.19 Favored 'General case' 0 N--CA 1.452 -0.366 0 CA-C-O 119.183 -0.437 . . . . 0.0 109.932 179.994 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 26.2 mt -63.13 -48.38 78.72 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 118.264 0.484 . . . . 0.0 111.437 176.535 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 9.1 mtpm? -61.93 -36.55 81.7 Favored 'General case' 0 CA--C 1.533 0.311 0 C-N-CA 123.291 0.636 . . . . 0.0 110.966 179.193 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -65.58 -54.22 30.96 Favored 'General case' 0 C--O 1.224 -0.262 0 O-C-N 122.103 -0.373 . . . . 0.0 110.656 169.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.1 mt -43.77 -71.93 0.07 Allowed 'General case' 0 C--O 1.227 -0.108 0 C-N-CA 124.638 1.175 . . . . 0.0 110.29 178.288 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 12.9 tt -50.72 -50.66 22.26 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 CA-C-O 121.777 0.799 . . . . 0.0 110.212 -170.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -53.9 -47.13 71.45 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 126.324 1.85 . . . . 0.0 111.87 177.657 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -75.26 -55.37 5.78 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 122.944 0.498 . . . . 0.0 110.658 -175.668 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . 0.261 0.0 OUTLIER -91.27 -7.58 50.75 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 114.898 1.444 . . . . 0.0 114.898 -168.587 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 62.5 mt -118.18 81.49 1.68 Allowed 'General case' 0 C--O 1.231 0.109 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 167.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 57.9 p -76.47 61.85 1.79 Allowed 'General case' 0 N--CA 1.453 -0.315 0 C-N-CA 125.017 1.327 . . . . 0.0 108.667 179.33 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 66.2 mt -85.57 -58.8 3.17 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.476 0 C-N-CA 124.522 1.129 . . . . 0.0 108.06 -176.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.67 -67.63 1.61 Allowed Glycine 0 CA--C 1.528 0.848 0 N-CA-C 110.842 -0.903 . . . . 0.0 110.842 179.369 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 27.8 p -70.61 78.52 0.59 Allowed 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 107.785 -1.191 . . . . 0.0 107.785 169.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 42.7 mttp -54.91 95.87 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.758 1.223 . . . . 0.0 111.422 -172.27 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 57.1 mt -31.46 -53.94 0.24 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 127.6 2.36 . . . . 0.0 114.117 -172.542 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -153.46 169.85 22.17 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 106.53 -1.655 . . . . 0.0 106.53 175.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -40.15 -36.46 0.5 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 127.25 2.22 . . . . 0.0 113.009 -175.251 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -28.53 -57.53 0.13 Allowed 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 126.909 2.083 . . . . 0.0 113.89 178.025 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 63.4 tt0 -66.84 -40.99 88.15 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 121.075 0.464 . . . . 0.0 110.901 -173.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.608 HD12 ' H ' ' A' ' 53' ' ' ILE . 1.8 mp -64.8 -51.24 69.6 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 -179.776 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 82.8 t -55.68 -43.06 72.03 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.561 0 C-N-CA 123.964 0.906 . . . . 0.0 110.098 177.559 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.27 -52.2 66.69 Favored 'General case' 0 C--O 1.232 0.159 0 CA-C-N 119.583 1.083 . . . . 0.0 111.003 174.673 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 37.5 mt -53.36 -41.44 65.84 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 119.491 -0.29 . . . . 0.0 111.401 179.156 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.5 -62.4 1.42 Allowed 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 118.399 0.545 . . . . 0.0 110.139 176.43 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -43.53 -39.98 3.7 Favored 'General case' 0 C--O 1.226 -0.162 0 C-N-CA 126.996 2.118 . . . . 0.0 111.572 -177.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -39.0 -49.7 1.72 Allowed 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 124.165 0.986 . . . . 0.0 112.261 173.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 10.4 mp -60.84 -48.37 82.12 Favored 'General case' 0 CA--C 1.532 0.26 0 N-CA-C 110.031 -0.359 . . . . 0.0 110.031 -177.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -61.29 -54.0 49.58 Favored 'General case' 0 CA--C 1.529 0.159 0 C-N-CA 123.095 0.558 . . . . 0.0 109.73 179.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.6 ttm180 -49.13 -44.95 42.96 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 124.599 1.16 . . . . 0.0 110.219 178.02 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 11.7 m-80 -80.69 19.43 0.83 Allowed 'General case' 0 CA--C 1.531 0.237 0 N-CA-C 113.508 0.929 . . . . 0.0 113.508 -178.299 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 7.3 mtmp? -58.46 -32.99 69.25 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 120.004 1.274 . . . . 0.0 107.936 165.268 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -70.8 8.22 0.94 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.931 1.292 . . . . 0.0 113.24 171.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 71.74 -53.68 0.68 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 127.397 2.279 . . . . 0.0 112.877 178.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 93.7 mt-10 -125.11 168.98 12.63 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 125.213 1.405 . . . . 0.0 109.984 179.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 18.7 m -132.0 151.1 34.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.342 0 C-N-CA 125.791 1.636 . . . . 0.0 106.976 169.269 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -90.31 170.94 9.83 Favored 'General case' 0 N--CA 1.462 0.166 0 C-N-CA 123.321 0.648 . . . . 0.0 111.037 175.253 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 73.6 t80 -34.51 -63.89 0.28 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.987 1.315 . . . . 0.0 113.123 171.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 50.3 tp60 -63.26 -32.34 73.73 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 119.768 1.167 . . . . 0.0 111.496 -173.064 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -68.45 -41.2 80.61 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 121.262 -0.899 . . . . 0.0 110.246 176.485 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -56.58 -50.54 71.64 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 109.357 -0.609 . . . . 0.0 109.357 170.994 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.6 mm -56.28 -38.3 54.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 O-C-N 121.848 -0.533 . . . . 0.0 110.087 176.463 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 90.4 m -66.63 -38.24 86.5 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 121.465 -0.772 . . . . 0.0 111.035 175.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 38.3 t80 -54.85 -54.49 41.68 Favored 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 108.935 -0.765 . . . . 0.0 108.935 172.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 53.8 mt -59.95 -40.89 90.56 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 111.763 0.283 . . . . 0.0 111.763 176.272 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.07 -47.05 91.8 Favored Glycine 0 CA--C 1.525 0.688 0 N-CA-C 110.895 -0.882 . . . . 0.0 110.895 -177.179 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -66.32 -45.21 81.09 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.37 0.668 . . . . 0.0 109.948 177.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 59.0 tp -49.53 -58.67 4.76 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-O 121.369 0.604 . . . . 0.0 109.983 173.573 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -48.59 -58.57 4.51 Favored 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 124.46 1.104 . . . . 0.0 110.294 176.006 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 56.5 ttm -50.89 -57.52 8.29 Favored 'General case' 0 N--CA 1.451 -0.398 0 C-N-CA 122.994 0.518 . . . . 0.0 110.883 -178.158 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 31.6 mt -61.04 -38.33 79.31 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 CA-C-O 117.937 -1.03 . . . . 0.0 110.91 -172.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.382 0.0 OUTLIER -97.05 7.65 46.19 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 115.229 1.566 . . . . 0.0 115.229 176.704 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -122.99 87.71 2.8 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 119.596 1.089 . . . . 0.0 109.883 169.229 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -38.48 -42.39 0.75 Allowed 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 126.041 1.737 . . . . 0.0 113.796 176.173 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -45.93 -46.32 16.04 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 123.385 0.674 . . . . 0.0 111.625 176.571 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 91.6 mt -73.7 4.03 5.62 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.618 0.767 . . . . 0.0 112.97 -177.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 9.4 mtmp? -116.45 10.87 14.73 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.596 1.159 . . . . 0.0 110.145 170.462 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.245 0 CA-C-O 117.009 -1.995 . . . . 0.0 110.891 -179.757 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 72.3 mtp . . . . . 0 N--CA 1.476 0.839 0 N-CA-C 110.476 -0.194 . . . . 0.0 110.476 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.43 70.55 3.83 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-O 121.174 0.511 . . . . 0.0 110.112 176.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 1.4 m -56.17 164.17 1.99 Allowed Pre-proline 0 CA--C 1.54 0.558 0 C-N-CA 124.256 1.023 . . . . 0.0 111.339 174.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo -47.56 -50.52 11.29 Favored 'Trans proline' 0 N--CA 1.458 -0.602 0 C-N-CA 123.013 2.475 . . . . 0.0 112.72 177.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.412 HD23 ' HA ' ' B' ' 5' ' ' LEU . 1.7 mt -60.52 -39.68 88.66 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-O 118.887 -0.578 . . . . 0.0 112.423 174.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -61.11 -45.88 92.86 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 119.291 0.951 . . . . 0.0 109.152 -179.304 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.9 tp60 -63.81 -43.92 94.81 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 116.717 -0.22 . . . . 0.0 111.081 177.106 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -66.31 -46.76 75.8 Favored 'General case' 0 CA--C 1.536 0.426 0 O-C-N 121.741 -0.599 . . . . 0.0 111.408 -177.42 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 76.7 mt -55.3 -52.16 48.53 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.188 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 170.268 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -45.19 -47.33 10.56 Favored Glycine 0 CA--C 1.528 0.866 0 C-N-CA 124.897 1.237 . . . . 0.0 111.906 174.803 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.5 mt -56.36 -59.01 5.58 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.442 0.697 . . . . 0.0 110.518 173.654 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.6 mp -57.25 -42.35 81.37 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 119.496 1.044 . . . . 0.0 112.061 -177.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 55.9 mt -58.77 -56.82 14.23 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 123.953 0.901 . . . . 0.0 110.439 174.168 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.06 -49.14 69.06 Favored Glycine 0 CA--C 1.522 0.513 0 N-CA-C 110.193 -1.163 . . . . 0.0 110.193 -176.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 8.5 mm -50.48 -53.51 12.26 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 C-N-CA 124.393 1.077 . . . . 0.0 109.99 174.138 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -52.64 -62.98 1.3 Allowed 'General case' 0 CA--C 1.528 0.117 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 177.079 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -51.03 -39.52 56.08 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.92 0.888 . . . . 0.0 111.745 -175.066 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -52.22 -34.82 47.38 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 123.969 0.907 . . . . 0.0 111.982 -179.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 94.6 m-85 -111.42 -35.61 5.77 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 118.3 0.5 . . . . 0.0 112.18 -177.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.6 m -64.91 -37.41 87.54 Favored 'General case' 0 CA--C 1.532 0.257 0 CA-C-N 119.028 0.831 . . . . 0.0 111.003 174.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -74.52 58.79 2.47 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 124.099 0.857 . . . . 0.0 112.984 -174.073 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 22.1 pttm -161.41 -37.25 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.845 1.258 . . . . 0.0 111.577 171.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -112.49 148.04 35.27 Favored 'General case' 0 C--N 1.339 0.15 0 C-N-CA 123.426 0.69 . . . . 0.0 111.497 -175.339 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 54.61 -145.61 27.87 Favored Glycine 0 CA--C 1.528 0.877 0 C-N-CA 124.452 1.025 . . . . 0.0 113.676 169.239 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 19.8 t0 -80.23 103.12 9.88 Favored 'General case' 0 C--O 1.223 -0.309 0 N-CA-C 106.99 -1.485 . . . . 0.0 106.99 175.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 40.7 mmtm -45.04 -35.4 2.96 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 116.324 1.972 . . . . 0.0 116.324 -168.084 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 38.8 p-80 -79.71 8.57 6.39 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 120.061 1.3 . . . . 0.0 113.798 177.129 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 17.0 p -135.72 171.93 13.75 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 126.79 2.036 . . . . 0.0 106.352 174.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -160.91 168.58 24.33 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 118.756 0.707 . . . . 0.0 110.485 173.836 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 8.4 t -116.25 -178.57 3.44 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 124.341 1.056 . . . . 0.0 112.256 -175.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 55.0 mttm -35.68 -66.61 0.19 Allowed 'General case' 0 C--O 1.234 0.285 0 C-N-CA 128.312 2.645 . . . . 0.0 113.235 -169.618 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 22.5 ttpp -50.82 -43.43 58.95 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.304 1.042 . . . . 0.0 110.589 -174.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -64.68 -35.61 81.6 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-O 118.723 -0.656 . . . . 0.0 111.602 -177.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -68.79 -51.38 41.57 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 119.502 1.047 . . . . 0.0 109.43 176.063 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -57.52 -42.35 82.68 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-O 120.996 0.427 . . . . 0.0 109.965 -178.482 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 55.9 tt0 -55.88 -65.66 0.56 Allowed 'General case' 0 N--CA 1.449 -0.475 0 C-N-CA 123.998 0.919 . . . . 0.0 109.233 169.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 4.9 mt -37.66 -60.65 0.69 Allowed 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 124.864 1.265 . . . . 0.0 112.003 179.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 18.3 tt -61.12 -48.53 88.59 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 -176.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 -56.5 -50.47 71.69 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.807 0.73 . . . . 0.0 112.063 179.284 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -70.35 -50.98 33.36 Favored 'General case' 0 CA--C 1.53 0.209 0 C-N-CA 123.231 0.612 . . . . 0.0 110.695 -174.123 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 76.4 mm-40 -96.38 -17.83 20.36 Favored 'General case' 0 N--CA 1.456 -0.151 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 -167.309 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 45.3 mt -113.91 70.95 0.74 Allowed 'General case' 0 CA--C 1.526 0.039 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 169.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 20.7 p -60.09 -40.53 89.9 Favored 'General case' 0 N--CA 1.453 -0.318 0 CA-C-N 115.781 -0.645 . . . . 0.0 109.484 171.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . 0.27 2.2 tt 65.21 -44.3 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.37 0 C-N-CA 129.391 3.076 . . . . 0.0 116.504 169.224 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 114.95 -137.06 13.66 Favored Glycine 0 CA--C 1.524 0.626 0 N-CA-C 107.003 -2.439 . . . . 0.0 107.003 -169.387 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 4.0 m -76.65 54.79 0.99 Allowed 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 117.82 0.81 . . . . 0.0 113.096 -173.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . 0.606 ' HB3' HD11 ' B' ' 53' ' ' ILE . 33.9 mtmm 41.38 67.32 0.56 Allowed 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.418 1.487 . . . . 0.0 111.37 178.535 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 16.1 mt -62.38 86.46 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 123.948 0.899 . . . . 0.0 112.741 -169.32 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 83.5 150.09 0.08 Allowed 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 127.445 2.298 . . . . 0.0 110.611 173.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -45.68 -36.85 5.2 Favored 'General case' 0 C--O 1.225 -0.227 0 C-N-CA 126.303 1.841 . . . . 0.0 113.511 -170.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.93 -60.24 0.17 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 126.108 1.763 . . . . 0.0 113.909 -179.317 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -63.57 -44.19 94.82 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 123.553 0.741 . . . . 0.0 110.843 -174.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 53' ' ' ILE . . . . . 0.636 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.4 mp -62.06 -52.38 61.15 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 N-CA-C 106.822 -1.547 . . . . 0.0 106.822 -177.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 75.6 t -53.86 -53.6 25.85 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.524 0 C-N-CA 123.961 0.905 . . . . 0.0 109.319 177.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -47.28 -52.5 16.01 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 118.698 0.681 . . . . 0.0 111.81 178.605 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 16.7 mt -50.57 -39.32 49.18 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 119.269 -0.396 . . . . 0.0 111.923 178.479 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 8.7 mmt -81.0 -64.72 1.13 Allowed 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 118.458 0.572 . . . . 0.0 109.737 178.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -34.82 -43.8 0.2 Allowed 'General case' 0 CA--C 1.523 -0.067 0 C-N-CA 128.046 2.538 . . . . 0.0 112.069 178.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -37.41 -50.95 1.1 Allowed 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.61 1.164 . . . . 0.0 112.577 176.067 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.8 pp -60.49 -33.13 72.16 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 111.826 0.306 . . . . 0.0 111.826 -173.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -83.54 -45.65 13.32 Favored 'General case' 0 N--CA 1.456 -0.125 0 C-N-CA 123.516 0.727 . . . . 0.0 109.746 176.764 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 52.8 ttt-85 -58.16 -37.14 74.11 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 122.178 -0.326 . . . . 0.0 110.955 -176.9 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -75.04 36.78 0.11 Allowed 'General case' 0 CA--C 1.537 0.458 0 O-C-N 121.478 -0.764 . . . . 0.0 112.357 177.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 63.6 mttt -63.02 -28.27 69.98 Favored 'General case' 0 CA--C 1.533 0.304 0 O-C-N 120.581 -1.324 . . . . 0.0 109.148 168.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -61.63 -13.32 21.29 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.104 0.961 . . . . 0.0 112.527 169.681 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 70.42 -63.53 0.4 Allowed 'General case' 0 C--N 1.342 0.247 0 C-N-CA 126.733 2.013 . . . . 0.0 110.649 -174.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -104.59 108.55 20.05 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 124.864 1.266 . . . . 0.0 107.642 172.677 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 28.4 m -79.58 136.08 24.31 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.261 0 N-CA-C 107.829 -1.175 . . . . 0.0 107.829 169.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 1.1 p30 -80.65 171.47 14.98 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-O 120.774 0.321 . . . . 0.0 111.186 176.682 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 55.9 t80 -38.12 -61.92 0.62 Allowed 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.401 1.08 . . . . 0.0 112.97 174.023 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 10.2 tp-100 -63.98 -32.52 74.09 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 120.391 1.45 . . . . 0.0 111.694 -175.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -64.52 -41.72 96.21 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 119.623 1.101 . . . . 0.0 110.162 175.15 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -57.95 -48.67 79.26 Favored 'General case' 0 CA--C 1.538 0.49 0 O-C-N 121.794 -0.566 . . . . 0.0 109.796 171.572 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 19.7 mm -60.83 -27.77 41.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 O-C-N 121.532 -0.73 . . . . 0.0 110.745 176.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 42.5 m -73.34 -38.69 65.67 Favored 'General case' 0 C--O 1.226 -0.181 0 O-C-N 121.076 -1.015 . . . . 0.0 110.171 172.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 36.6 t80 -54.33 -54.76 36.01 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 171.175 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 32.8 mt -59.9 -47.65 84.88 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 112.057 0.391 . . . . 0.0 112.057 177.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -63.69 -39.83 97.93 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 111.021 -0.831 . . . . 0.0 111.021 -174.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -70.69 -47.85 57.74 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 123.882 0.873 . . . . 0.0 110.22 176.674 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -47.58 -53.74 13.72 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 123.933 0.893 . . . . 0.0 109.565 173.034 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -55.12 -56.31 21.25 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 124.259 1.024 . . . . 0.0 110.365 174.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 51.5 ttm -50.55 -42.95 55.96 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.516 0.598 . . . . 0.0 111.763 -178.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 42.8 mt -67.88 -58.39 6.24 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.442 0 CA-C-O 118.385 -0.817 . . . . 0.0 110.644 -179.627 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.364 1.0 OUTLIER -77.42 -38.39 49.79 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 119.94 1.246 . . . . 0.0 113.385 -174.674 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -78.75 64.86 3.84 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 170.295 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 60.0 mt-10 -46.91 -31.29 3.03 Favored 'General case' 0 N--CA 1.464 0.228 0 C-N-CA 125.702 1.601 . . . . 0.0 112.802 -174.082 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -45.48 -36.92 4.79 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.06 0.944 . . . . 0.0 112.767 175.041 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 83.8 mt -62.95 -27.04 69.12 Favored 'General case' 0 CA--C 1.533 0.299 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 178.267 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -85.34 -48.61 8.88 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 118.539 0.609 . . . . 0.0 109.379 169.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.159 0 CA-C-O 117.534 -1.703 . . . . 0.0 110.086 -179.144 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 tmt? . . . . . 0 N--CA 1.474 0.736 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -77.58 73.09 4.15 Favored 'General case' 0 N--CA 1.455 -0.192 0 C-N-CA 122.744 0.418 . . . . 0.0 111.214 -174.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 2.7 m -54.51 161.71 1.99 Allowed Pre-proline 0 CA--C 1.538 0.518 0 C-N-CA 123.829 0.852 . . . . 0.0 111.193 173.213 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_exo -45.57 -49.08 11.08 Favored 'Trans proline' 0 N--CA 1.46 -0.453 0 C-N-CA 123.519 2.813 . . . . 0.0 113.573 -179.39 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.8 mt -55.62 -52.93 62.12 Favored 'General case' 0 C--O 1.226 -0.168 0 N-CA-C 111.769 0.285 . . . . 0.0 111.769 174.328 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -60.24 -41.44 93.14 Favored 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 -175.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.0 tp-100 -60.98 -51.08 70.76 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.57 0.748 . . . . 0.0 110.493 176.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.99 -45.81 93.31 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.338 0.655 . . . . 0.0 111.146 -178.77 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 67.2 mt -53.59 -52.16 36.07 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 170.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.69 -47.74 23.88 Favored Glycine 0 CA--C 1.525 0.712 0 C-N-CA 125.369 1.462 . . . . 0.0 111.601 175.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.0 mt -55.98 -54.59 42.96 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 117.726 0.763 . . . . 0.0 110.995 174.443 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -58.99 -43.93 91.53 Favored 'General case' 0 CA--C 1.537 0.476 0 CA-C-N 118.87 0.759 . . . . 0.0 111.558 -179.299 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 96.2 mt -58.05 -49.29 81.9 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 123.007 0.523 . . . . 0.0 110.173 173.546 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.75 -51.54 54.4 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 110.102 -1.199 . . . . 0.0 110.102 -178.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 8.2 mm -54.81 -49.35 70.05 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 C-N-CA 123.273 0.629 . . . . 0.0 109.745 175.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . 0.401 ' HB2' ' CE2' ' A' ' 73' ' ' TYR . 32.2 t80 -53.48 -55.67 23.36 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 121.479 0.657 . . . . 0.0 110.985 178.077 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 74.2 t60 -64.79 -32.39 74.05 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.346 -175.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 65.3 tttm -53.11 -49.65 66.07 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 118.882 0.764 . . . . 0.0 110.712 176.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -89.96 -36.04 15.21 Favored 'General case' 0 CA--C 1.53 0.211 0 O-C-N 122.323 -0.236 . . . . 0.0 111.321 -175.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 20.3 t -63.62 -31.64 72.87 Favored 'General case' 0 CA--C 1.538 0.487 0 O-C-N 121.775 -0.578 . . . . 0.0 110.641 173.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -39.88 -37.19 0.92 Allowed Glycine 0 CA--C 1.525 0.701 0 C-N-CA 128.296 2.855 . . . . 0.0 115.334 -176.025 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 23.3 pttp -77.84 -20.33 53.3 Favored 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 113.241 0.83 . . . . 0.0 113.241 -176.282 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -82.23 173.45 12.08 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 123.486 0.714 . . . . 0.0 110.43 -176.407 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -65.86 -60.63 6.29 Favored Glycine 0 CA--C 1.53 0.989 0 N-CA-C 110.411 -1.075 . . . . 0.0 110.411 178.167 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -84.84 90.51 7.79 Favored 'General case' 0 N--CA 1.455 -0.205 0 N-CA-C 107.92 -1.141 . . . . 0.0 107.92 176.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 59.9 mttm -76.1 37.24 0.15 Allowed 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.517 1.127 . . . . 0.0 113.568 -169.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 4.6 p80 -150.63 38.44 0.69 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 126.214 1.805 . . . . 0.0 108.562 172.337 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -161.41 141.58 10.7 Favored 'General case' 0 N--CA 1.455 -0.206 0 N-CA-C 105.694 -1.965 . . . . 0.0 105.694 -177.323 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -160.01 174.82 13.78 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 119.008 0.822 . . . . 0.0 110.661 -176.79 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 59.6 p -124.57 174.38 7.86 Favored 'General case' 0 CA--C 1.529 0.144 0 CA-C-N 118.808 0.731 . . . . 0.0 112.579 -170.025 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -27.39 -53.47 0.08 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 128.348 2.659 . . . . 0.0 114.016 169.664 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.07 -54.77 40.98 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.805 0.842 . . . . 0.0 109.713 179.724 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 14.2 mp0 -66.11 -34.34 77.83 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-O 118.642 -0.694 . . . . 0.0 110.527 -177.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 60.2 mt -65.13 -50.06 67.51 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 119.317 0.962 . . . . 0.0 110.999 177.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 40.7 mttp -57.19 -49.16 76.83 Favored 'General case' 0 CA--C 1.533 0.306 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 174.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 81.8 tt0 -53.09 -54.73 31.26 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 123.644 0.778 . . . . 0.0 110.302 177.006 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.6 mt -48.42 -65.29 0.59 Allowed 'General case' 0 CA--C 1.52 -0.196 0 C-N-CA 126.099 1.759 . . . . 0.0 110.171 177.4 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 16.9 tt -59.89 -44.76 95.03 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.275 0 N-CA-C 109.543 -0.539 . . . . 0.0 109.543 -171.442 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 16.6 tt0 -60.16 -53.51 56.93 Favored 'General case' 0 CA--C 1.535 0.385 0 N-CA-C 111.855 0.317 . . . . 0.0 111.855 179.364 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -67.82 -49.19 63.58 Favored 'General case' 0 C--O 1.227 -0.083 0 O-C-N 121.825 -0.547 . . . . 0.0 109.576 -174.133 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 72.8 mm-40 -74.63 -65.05 0.91 Allowed 'General case' 0 N--CA 1.448 -0.538 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 -175.767 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 89.3 mt -88.42 67.26 8.57 Favored 'General case' 0 N--CA 1.455 -0.2 0 N-CA-C 108.477 -0.934 . . . . 0.0 108.477 -178.068 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 38.8 p -47.99 -65.04 0.63 Allowed 'General case' 0 N--CA 1.455 -0.176 0 C-N-CA 124.366 1.066 . . . . 0.0 109.838 177.156 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 48.8 mt 64.8 -64.39 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 C-N-CA 127.205 2.202 . . . . 0.0 111.978 173.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.36 -66.09 1.97 Allowed Glycine 0 CA--C 1.526 0.78 0 N-CA-C 110.066 -1.214 . . . . 0.0 110.066 -178.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 21.0 m -68.29 75.54 0.24 Allowed 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 124.373 1.069 . . . . 0.0 109.223 170.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 23.4 mmtp -47.45 93.89 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 126.032 1.733 . . . . 0.0 110.825 -179.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 87.9 mt -46.31 -54.55 8.73 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 125.637 1.575 . . . . 0.0 112.982 -169.542 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -166.72 162.07 16.02 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 106.158 -1.793 . . . . 0.0 106.158 -169.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -38.09 -40.8 0.52 Allowed 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 126.643 1.977 . . . . 0.0 114.773 -171.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.86 -59.56 0.17 Allowed 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 125.796 1.639 . . . . 0.0 114.66 -178.237 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 17.6 tt0 -65.57 -40.27 92.58 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-O 121.13 0.491 . . . . 0.0 111.214 -174.265 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.643 HD12 ' H ' ' A' ' 53' ' ' ILE . 2.2 mp -63.83 -51.86 64.36 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 -179.934 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 69.2 t -55.13 -43.7 71.34 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 C-N-CA 124.401 1.081 . . . . 0.0 110.348 178.466 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -56.34 -54.41 45.78 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 119.205 0.911 . . . . 0.0 110.454 173.89 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 57.5 mt -54.18 -40.02 67.15 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 119.267 -0.397 . . . . 0.0 111.2 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 25.3 mmt -68.62 -65.01 0.75 Allowed 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.549 0.613 . . . . 0.0 109.711 175.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -40.69 -40.46 1.31 Allowed 'General case' 0 N--CA 1.462 0.171 0 C-N-CA 128.077 2.551 . . . . 0.0 111.886 -177.572 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.5 t70 -38.43 -48.55 1.38 Allowed 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 124.479 1.112 . . . . 0.0 111.876 175.284 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -61.33 -38.29 86.37 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 118.393 0.542 . . . . 0.0 111.838 -176.551 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -76.15 -51.19 12.68 Favored 'General case' 0 N--CA 1.457 -0.106 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 16.9 ttm180 -48.51 -46.85 38.98 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 123.571 0.748 . . . . 0.0 109.926 177.215 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 8.0 m-80 -86.23 29.06 0.77 Allowed 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -177.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 20.0 pttp -57.46 -35.73 70.51 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.157 -0.965 . . . . 0.0 108.84 166.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -74.29 3.7 6.9 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.938 1.295 . . . . 0.0 112.623 173.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 79.1 mm-40 68.72 -63.61 0.35 Allowed 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 127.017 2.127 . . . . 0.0 112.054 -178.211 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 4.8 mp0 -97.63 162.06 13.47 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 123.983 0.913 . . . . 0.0 109.844 177.111 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 27.4 m -137.38 149.65 25.79 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 C-N-CA 126.044 1.738 . . . . 0.0 108.079 174.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -89.49 175.71 7.19 Favored 'General case' 0 C--N 1.339 0.142 0 C-N-CA 124.285 1.034 . . . . 0.0 111.108 176.989 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -39.46 -64.74 0.44 Allowed 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 125.275 1.43 . . . . 0.0 112.967 174.483 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 11.0 tp-100 -65.03 -32.22 73.83 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 120.242 1.383 . . . . 0.0 111.807 -172.578 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -65.22 -44.47 88.15 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 119.033 0.833 . . . . 0.0 110.419 175.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . 0.401 ' CE2' ' HB2' ' A' ' 16' ' ' PHE . 0.7 OUTLIER -55.92 -54.31 46.28 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 172.279 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 20.7 mm -52.06 -46.37 42.63 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.312 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 178.419 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 92.9 m -59.35 -27.8 66.26 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 123.464 0.706 . . . . 0.0 111.795 179.084 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 11.4 t80 -59.69 -52.13 66.84 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 119.464 1.029 . . . . 0.0 108.436 172.166 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 56.2 mt -67.26 -40.05 86.15 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 123.853 0.861 . . . . 0.0 111.699 -179.538 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.51 -45.12 69.38 Favored Glycine 0 CA--C 1.524 0.642 0 N-CA-C 110.135 -1.186 . . . . 0.0 110.135 -178.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.02 -48.58 81.13 Favored 'General case' 0 N--CA 1.451 -0.387 0 O-C-N 122.279 -0.541 . . . . 0.0 109.796 173.246 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 22.5 tp -50.44 -57.03 8.97 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.407 0.622 . . . . 0.0 109.807 176.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.1 -55.04 16.57 Favored 'General case' 0 N--CA 1.446 -0.662 0 C-N-CA 124.56 1.144 . . . . 0.0 110.247 177.294 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 7.7 ttp -59.82 -45.07 93.53 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 122.925 0.49 . . . . 0.0 111.516 -175.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 93.0 mt -64.63 -52.94 48.4 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 CA-C-O 117.995 -1.002 . . . . 0.0 110.281 -177.874 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.445 0.0 OUTLIER -79.3 -34.06 42.73 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 120.034 1.288 . . . . 0.0 113.887 -176.121 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 32.5 m-80 -80.1 72.93 6.92 Favored 'General case' 0 N--CA 1.462 0.164 0 N-CA-C 107.158 -1.423 . . . . 0.0 107.158 169.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -47.79 -30.48 4.01 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.956 1.302 . . . . 0.0 113.097 -171.756 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -38.79 -47.02 1.34 Allowed 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.959 1.304 . . . . 0.0 112.39 169.817 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.4 mt -72.49 6.54 2.31 Favored 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 113.619 0.97 . . . . 0.0 113.619 -177.241 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 52.7 mtmt -106.61 8.22 31.09 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 119.507 1.049 . . . . 0.0 109.908 167.386 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.116 0 CA-C-O 117.384 -1.787 . . . . 0.0 108.846 171.573 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 61.9 ttp . . . . . 0 N--CA 1.474 0.754 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -79.25 63.2 3.82 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-O 121.249 0.547 . . . . 0.0 110.378 176.772 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 2.5 m -59.63 166.41 3.33 Favored Pre-proline 0 CA--C 1.539 0.549 0 C-N-CA 125.134 1.374 . . . . 0.0 111.202 178.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_exo -45.75 -47.26 14.05 Favored 'Trans proline' 0 N--CA 1.459 -0.5 0 C-N-CA 123.257 2.638 . . . . 0.0 112.927 177.652 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.428 HD23 ' HA ' ' B' ' 5' ' ' LEU . 6.2 mt -56.67 -49.23 75.69 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-O 119.329 -0.367 . . . . 0.0 111.514 174.249 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -58.21 -46.74 85.31 Favored 'General case' 0 N--CA 1.457 -0.124 0 CA-C-N 118.488 0.585 . . . . 0.0 109.853 -178.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 -57.54 -51.0 71.25 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 122.759 0.424 . . . . 0.0 110.575 177.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.5 -45.7 82.55 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.49 0.716 . . . . 0.0 111.867 -175.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 81.7 mt -55.88 -50.08 70.97 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.275 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 172.002 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.37 -50.39 17.84 Favored Glycine 0 CA--C 1.527 0.841 0 C-N-CA 124.886 1.231 . . . . 0.0 111.5 173.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 3.1 mt -54.24 -57.59 10.59 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 117.474 0.637 . . . . 0.0 110.702 174.223 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 9.9 mp -57.42 -43.44 83.82 Favored 'General case' 0 CA--C 1.538 0.5 0 CA-C-N 119.391 0.996 . . . . 0.0 112.032 -177.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 85.8 mt -56.97 -58.03 7.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 C-N-CA 123.171 0.588 . . . . 0.0 110.12 173.711 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.25 -49.5 67.86 Favored Glycine 0 CA--C 1.524 0.605 0 N-CA-C 110.553 -1.019 . . . . 0.0 110.553 -175.269 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.3 mm -49.68 -50.99 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 C-N-CA 124.139 0.976 . . . . 0.0 109.935 173.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 56.4 t80 -57.46 -58.94 6.1 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 121.042 0.449 . . . . 0.0 110.008 178.05 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 7.1 t-80 -51.55 -36.98 47.43 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.051 0.94 . . . . 0.0 111.626 -176.513 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -51.56 -34.04 34.97 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.298 1.039 . . . . 0.0 112.474 178.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -111.61 -47.41 3.16 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 118.6 0.636 . . . . 0.0 110.688 179.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 1.2 m -72.42 -42.65 64.87 Favored 'General case' 0 N--CA 1.455 -0.203 0 C-N-CA 123.266 0.626 . . . . 0.0 111.963 -176.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -80.41 66.36 3.68 Favored Glycine 0 N--CA 1.446 -0.646 0 CA-C-N 116.097 -0.501 . . . . 0.0 112.177 -167.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 5.9 mtmp? -89.04 -61.82 1.62 Allowed 'General case' 0 N--CA 1.445 -0.678 0 C-N-CA 123.858 0.863 . . . . 0.0 109.108 -178.23 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -169.02 168.99 9.83 Favored 'General case' 0 N--CA 1.451 -0.399 0 C-N-CA 125.612 1.565 . . . . 0.0 106.937 179.207 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 52.89 -106.56 0.41 Allowed Glycine 0 CA--C 1.528 0.871 0 C-N-CA 123.687 0.661 . . . . 0.0 112.053 174.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -79.98 55.94 2.25 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.178 0.991 . . . . 0.0 110.906 -175.454 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 38.9 mtmt -53.87 -27.96 33.27 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 123.902 0.881 . . . . 0.0 112.662 -177.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -78.33 6.52 8.15 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 114.109 1.152 . . . . 0.0 114.109 -175.328 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -138.85 151.91 47.38 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.078 1.351 . . . . 0.0 109.474 -170.201 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -156.09 166.38 33.62 Favored 'General case' 0 CA--C 1.528 0.13 0 C-N-CA 123.26 0.624 . . . . 0.0 110.779 174.031 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 67.9 m -111.76 174.68 5.76 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 125.145 1.378 . . . . 0.0 112.818 -176.197 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -37.81 -55.38 1.19 Allowed 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 126.913 2.085 . . . . 0.0 114.545 -177.683 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -53.56 -48.51 69.08 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 -176.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -61.14 -38.65 87.16 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 123.041 0.536 . . . . 0.0 111.324 179.133 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 85.0 mt -63.27 -49.33 74.48 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 119.214 0.916 . . . . 0.0 111.038 175.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -57.56 -47.17 82.79 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 109.836 -0.431 . . . . 0.0 109.836 177.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -58.17 -47.41 83.49 Favored 'General case' 0 C--O 1.22 -0.494 0 CA-C-O 119.024 -0.512 . . . . 0.0 110.791 175.232 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 8.9 mt -50.76 -53.58 30.56 Favored 'General case' 0 CA--C 1.528 0.131 0 CA-C-N 119.655 1.116 . . . . 0.0 110.176 178.242 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 35.9 mt -56.78 -60.34 2.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 C-N-CA 120.921 -0.312 . . . . 0.0 110.212 175.558 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 21.1 tt0 -53.07 -48.98 67.3 Favored 'General case' 0 CA--C 1.536 0.434 0 O-C-N 121.621 -0.674 . . . . 0.0 112.496 -173.476 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 9.5 mmpt? -79.53 -48.97 12.96 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 125.564 1.546 . . . . 0.0 110.551 -171.178 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 28.2 mm-40 -101.89 -12.42 18.26 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 113.698 0.999 . . . . 0.0 113.698 -168.435 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 57.2 mt -116.33 72.33 0.81 Allowed 'General case' 0 C--O 1.231 0.102 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 169.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 73.4 p -77.9 49.97 0.82 Allowed 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 125.218 1.407 . . . . 0.0 109.414 178.191 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 36.3 mt -66.15 -43.45 92.07 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.265 0 C-N-CA 123.277 0.631 . . . . 0.0 109.71 -170.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 73.73 -65.98 1.75 Allowed Glycine 0 CA--C 1.528 0.892 0 N-CA-C 110.265 -1.134 . . . . 0.0 110.265 -176.895 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 17.7 m -68.45 72.55 0.21 Allowed 'General case' 0 N--CA 1.453 -0.279 0 C-N-CA 125.269 1.428 . . . . 0.0 110.327 174.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . 0.418 ' HB3' HD11 ' B' ' 53' ' ' ILE . 30.9 mmtm -40.9 90.5 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 127.617 2.367 . . . . 0.0 112.665 179.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 86.1 mt -67.08 111.34 3.82 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 124.058 0.943 . . . . 0.0 112.667 -170.491 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 68.44 -69.28 0.15 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.154 1.781 . . . . 0.0 113.9 166.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 18.3 p-10 -178.33 -42.3 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.189 0 C-N-CA 125.55 1.54 . . . . 0.0 110.282 -170.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.84 -63.57 0.13 Allowed 'General case' 0 C--O 1.226 -0.142 0 C-N-CA 126.198 1.799 . . . . 0.0 114.133 -174.242 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -66.17 -37.54 85.89 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 122.747 0.419 . . . . 0.0 111.32 -172.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 53' ' ' ILE . . . . . 0.634 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.4 mp -62.28 -52.76 56.2 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.425 0 N-CA-C 106.076 -1.824 . . . . 0.0 106.076 177.841 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 71.9 t -54.04 -40.87 47.68 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 C-N-CA 124.23 1.012 . . . . 0.0 110.41 176.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 12.8 mmmt -60.94 -51.22 70.21 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 120.187 1.358 . . . . 0.0 110.484 175.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 76.3 mt -56.96 -36.41 70.26 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 119.148 -0.454 . . . . 0.0 110.906 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 25.2 mmt -70.26 -62.49 1.37 Allowed 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 118.739 0.699 . . . . 0.0 109.808 173.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -46.61 -30.47 2.31 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 128.132 2.573 . . . . 0.0 112.405 -176.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -38.29 -48.17 1.28 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.508 1.123 . . . . 0.0 111.268 169.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.9 pp -58.52 -34.32 70.83 Favored 'General case' 0 CA--C 1.534 0.327 0 O-C-N 121.144 -0.972 . . . . 0.0 112.167 -178.764 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -78.42 -55.95 4.82 Favored 'General case' 0 N--CA 1.454 -0.226 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 178.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 16.5 mmt180 -42.11 -50.35 4.75 Favored 'General case' 0 CA--C 1.528 0.114 0 C-N-CA 124.972 1.309 . . . . 0.0 110.646 176.371 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 25.5 m120 -94.81 25.02 4.3 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 123.971 0.908 . . . . 0.0 111.849 -171.456 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 7.4 mtmp? -55.92 -39.1 71.17 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 119.639 1.109 . . . . 0.0 109.355 168.152 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -80.5 13.02 2.67 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 123.931 0.892 . . . . 0.0 112.121 175.512 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 65.68 -68.03 0.13 Allowed 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 126.581 1.953 . . . . 0.0 111.43 -172.47 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 33.4 mm-40 -87.89 154.83 20.22 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 125.149 1.38 . . . . 0.0 111.309 -172.74 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 34.9 m -132.58 147.6 31.86 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.288 0 N-CA-C 105.618 -1.993 . . . . 0.0 105.618 165.713 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 20.2 p30 -89.24 171.6 9.67 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 123.556 0.742 . . . . 0.0 110.884 176.746 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -39.97 -60.85 0.95 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.568 1.147 . . . . 0.0 113.16 175.186 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -64.56 -35.99 82.78 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 120.314 1.416 . . . . 0.0 111.362 -174.167 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.77 -40.27 96.27 Favored 'General case' 0 CA--C 1.536 0.416 0 O-C-N 121.561 -0.712 . . . . 0.0 110.578 175.194 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -57.2 -49.68 75.25 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 118.571 0.623 . . . . 0.0 109.964 169.653 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 24.6 mm -58.62 -28.14 36.05 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 O-C-N 121.384 -0.822 . . . . 0.0 110.709 176.779 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 30.1 m -80.25 -23.48 40.79 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 124.231 1.012 . . . . 0.0 111.786 173.366 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -67.56 -53.48 28.0 Favored 'General case' 0 CA--C 1.531 0.223 0 N-CA-C 107.673 -1.232 . . . . 0.0 107.673 169.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 40.9 mt -57.65 -41.65 81.91 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-O 120.908 0.385 . . . . 0.0 110.668 171.661 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.76 -53.1 46.53 Favored Glycine 0 CA--C 1.523 0.577 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 179.329 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.75 -47.31 85.8 Favored 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 122.83 0.452 . . . . 0.0 110.641 178.218 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 11.3 tp -48.06 -60.54 2.54 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-O 121.978 0.894 . . . . 0.0 110.082 175.155 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -51.85 -56.64 12.78 Favored 'General case' 0 N--CA 1.446 -0.674 0 C-N-CA 125.31 1.444 . . . . 0.0 110.294 -179.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 56.6 ttm -56.26 -43.42 78.71 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 123.737 0.815 . . . . 0.0 110.989 -178.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 96.4 mt -67.9 -55.74 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.485 0 CA-C-O 118.415 -0.802 . . . . 0.0 109.533 -175.613 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.4 0.4 OUTLIER -73.13 -33.63 65.64 Favored 'General case' 0 C--N 1.344 0.356 0 C-N-CA 118.325 -1.35 . . . . 0.0 112.803 -175.982 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 30.2 m-80 -81.14 64.98 6.1 Favored 'General case' 0 N--CA 1.464 0.275 0 N-CA-C 107.565 -1.272 . . . . 0.0 107.565 169.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -42.22 -37.96 1.63 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 125.138 1.375 . . . . 0.0 112.747 -176.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.69 -54.0 0.44 Allowed 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 126.093 1.757 . . . . 0.0 112.65 169.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 61.7 mt -63.49 -17.79 63.11 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 113.157 0.799 . . . . 0.0 113.157 -173.285 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -68.02 -27.97 67.0 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 118.676 0.671 . . . . 0.0 110.91 174.341 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.169 0 CA-C-O 117.167 -1.907 . . . . 0.0 110.921 -169.912 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.5 mtm . . . . . 0 N--CA 1.476 0.835 0 CA-C-O 120.25 0.071 . . . . 0.0 110.86 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -75.77 71.03 2.6 Favored 'General case' 0 CA--C 1.529 0.137 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 173.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.4 m -56.01 163.79 2.07 Favored Pre-proline 0 CA--C 1.54 0.593 0 C-N-CA 124.204 1.002 . . . . 0.0 111.352 177.049 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -46.62 -49.02 12.71 Favored 'Trans proline' 0 N--CA 1.459 -0.528 0 C-N-CA 123.255 2.637 . . . . 0.0 112.831 178.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 6.2 mt -58.64 -46.39 87.22 Favored 'General case' 0 C--O 1.224 -0.248 0 CA-C-O 119.193 -0.432 . . . . 0.0 111.543 175.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 23.5 t70 -56.97 -48.18 79.0 Favored 'General case' 0 C--O 1.227 -0.131 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 -179.025 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 13.3 tp60 -62.81 -44.44 96.14 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.275 179.146 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.4 -46.17 81.08 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-O 121.355 0.598 . . . . 0.0 111.328 -178.181 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 72.4 mt -54.55 -50.86 55.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 170.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.51 -48.98 16.48 Favored Glycine 0 CA--C 1.527 0.817 0 C-N-CA 124.646 1.117 . . . . 0.0 111.729 173.983 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 mt -55.36 -55.34 32.71 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 117.767 0.784 . . . . 0.0 110.945 174.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -58.91 -45.2 90.9 Favored 'General case' 0 CA--C 1.538 0.483 0 CA-C-N 119.012 0.824 . . . . 0.0 111.839 -178.04 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.415 HD11 ' HB1' ' B' ' 81' ' ' ALA . 90.5 mt -59.5 -50.98 77.91 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.33 0 C-N-CA 122.857 0.463 . . . . 0.0 110.354 175.073 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -53.59 -54.07 32.3 Favored Glycine 0 CA--C 1.523 0.539 0 N-CA-C 109.763 -1.335 . . . . 0.0 109.763 -179.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 6.8 mm -50.53 -51.7 18.24 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.336 0 C-N-CA 124.079 0.952 . . . . 0.0 110.12 174.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -51.51 -57.25 9.57 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 118.022 0.374 . . . . 0.0 110.594 178.454 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.416 ' HA ' ' H ' ' A' ' 21' ' ' GLY . 6.5 m-70 -70.3 -21.7 62.91 Favored 'General case' 0 C--O 1.232 0.163 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 -174.756 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.8 ttpp -57.93 -18.57 24.09 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-O 119.034 -0.508 . . . . 0.0 111.342 169.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -115.92 -67.72 0.97 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.743 0.817 . . . . 0.0 110.273 171.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 30.9 p -51.03 -65.92 0.47 Allowed 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.714 0.769 . . . . 0.0 111.158 -173.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . 0.416 ' H ' ' HA ' ' A' ' 17' ' ' HIS . . . -34.19 -56.32 0.71 Allowed Glycine 0 CA--C 1.52 0.406 0 C-N-CA 128.465 2.936 . . . . 0.0 112.089 178.151 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -77.43 -37.92 50.67 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -177.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -76.78 48.11 0.55 Allowed 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 119.284 0.947 . . . . 0.0 112.492 -176.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 73.4 -67.12 1.55 Allowed Glycine 0 CA--C 1.529 0.966 0 O-C-N 121.299 -0.876 . . . . 0.0 113.558 169.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -80.15 57.74 2.8 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.298 1.039 . . . . 0.0 110.922 -171.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 28.8 mttp -35.41 -42.55 0.21 Allowed 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 128.03 2.532 . . . . 0.0 117.453 -167.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 16.1 m170 -84.03 -7.65 59.34 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.848 0.859 . . . . 0.0 112.748 -174.103 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 1.3 p -138.35 173.39 11.66 Favored 'General case' 0 N--CA 1.449 -0.478 0 C-N-CA 126.876 2.071 . . . . 0.0 109.585 -168.216 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 3.7 pp -160.2 -173.86 4.24 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 169.384 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 77.8 p -129.95 172.84 11.28 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 119.697 1.135 . . . . 0.0 112.568 -179.582 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.7 ptmm? -31.69 -51.06 0.21 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 126.107 1.763 . . . . 0.0 113.512 169.491 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.7 ttpt -60.87 -47.53 85.98 Favored 'General case' 0 N--CA 1.449 -0.479 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -177.241 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 6.0 mp0 -66.55 -35.44 80.23 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 118.428 -0.796 . . . . 0.0 110.559 179.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 73.7 mt -61.52 -51.38 68.85 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.779 1.172 . . . . 0.0 111.032 174.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.0 mtpp -60.11 -45.12 94.03 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-O 120.841 0.353 . . . . 0.0 110.279 179.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -54.52 -54.93 34.58 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.112 0.965 . . . . 0.0 110.521 173.661 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.0 mt -49.02 -61.19 2.2 Favored 'General case' 0 CA--C 1.52 -0.207 0 C-N-CA 125.382 1.473 . . . . 0.0 110.033 178.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 20.2 tt -59.71 -48.74 86.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 C-N-CA 119.872 -0.731 . . . . 0.0 109.724 -176.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 -54.88 -50.11 69.54 Favored 'General case' 0 CA--C 1.539 0.528 0 O-C-N 121.88 -0.512 . . . . 0.0 112.208 -178.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.7 -54.21 7.32 Favored 'General case' 0 CA--C 1.531 0.24 0 O-C-N 121.908 -0.495 . . . . 0.0 110.714 -176.862 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 49.8 mm-40 -82.4 -21.81 35.64 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 -167.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 23.0 mt -117.78 79.21 1.33 Allowed 'General case' 0 C--O 1.227 -0.086 0 N-CA-C 107.787 -1.19 . . . . 0.0 107.787 174.437 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 34.1 p -65.98 -64.85 0.77 Allowed 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 -178.261 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . 0.26 45.6 mt 66.06 -60.53 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 C-N-CA 126.695 1.998 . . . . 0.0 113.015 174.405 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 74.08 -67.07 1.79 Allowed Glycine 0 CA--C 1.526 0.768 0 N-CA-C 110.323 -1.111 . . . . 0.0 110.323 -179.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 56.0 m -70.03 79.16 0.49 Allowed 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 169.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 21.6 mmtm -55.21 83.63 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 125.913 1.685 . . . . 0.0 111.393 -178.123 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 75.4 mt -30.29 -58.24 0.19 Allowed 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 128.155 2.582 . . . . 0.0 113.938 -172.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -162.84 162.7 26.58 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 106.506 -1.665 . . . . 0.0 106.506 -175.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -34.33 -42.91 0.15 Allowed 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 128.101 2.56 . . . . 0.0 114.505 -172.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.37 -60.91 0.14 Allowed 'General case' 0 C--O 1.226 -0.177 0 C-N-CA 125.874 1.67 . . . . 0.0 113.313 -176.331 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -64.56 -38.09 89.82 Favored 'General case' 0 N--CA 1.454 -0.239 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -173.316 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.479 HD12 ' H ' ' A' ' 53' ' ' ILE . 1.2 mp -61.64 -54.97 27.59 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 N-CA-C 106.159 -1.793 . . . . 0.0 106.159 176.519 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 79.1 t -51.49 -49.62 32.22 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.495 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.079 -178.298 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 6.4 mmmm -51.86 -47.61 64.37 Favored 'General case' 0 C--N 1.339 0.111 0 CA-C-N 119.59 1.086 . . . . 0.0 111.753 -176.567 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 32.9 mt -57.33 -35.61 70.1 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 119.283 -0.389 . . . . 0.0 111.543 -178.011 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.28 -62.87 1.55 Allowed 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 176.128 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -40.57 -40.36 1.24 Allowed 'General case' 0 CA--C 1.523 -0.094 0 C-N-CA 127.528 2.331 . . . . 0.0 111.877 -179.351 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -38.52 -47.57 1.3 Allowed 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.811 1.244 . . . . 0.0 112.009 175.715 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -57.6 -51.89 67.65 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 118.124 0.42 . . . . 0.0 110.713 -178.44 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -74.44 -31.38 62.26 Favored 'General case' 0 C--O 1.224 -0.262 0 C-N-CA 123.231 0.613 . . . . 0.0 111.383 -176.215 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.5 ttm180 -63.14 -53.86 46.8 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 173.315 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 -83.17 52.98 2.32 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 123.604 0.762 . . . . 0.0 110.096 -172.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 76.6 mttt -58.06 -41.92 84.35 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 108.733 -0.839 . . . . 0.0 108.733 172.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -67.5 -5.7 16.3 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.083 1.353 . . . . 0.0 113.163 175.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 66.8 mm-40 70.78 -57.79 0.58 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 126.456 1.902 . . . . 0.0 111.595 -175.17 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -87.2 156.75 19.54 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.572 1.549 . . . . 0.0 110.735 177.607 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 4.2 m -143.93 159.79 16.03 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.316 0 C-N-CA 127.218 2.207 . . . . 0.0 107.87 174.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -101.04 170.92 7.95 Favored 'General case' 0 N--CA 1.462 0.157 0 C-N-CA 125.086 1.354 . . . . 0.0 110.964 175.812 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 73.9 t80 -35.12 -63.42 0.33 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 124.685 1.194 . . . . 0.0 112.945 171.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 28.9 tp60 -67.03 -29.04 68.74 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 119.633 1.106 . . . . 0.0 111.81 -171.939 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 30.5 mt-10 -65.72 -43.23 89.73 Favored 'General case' 0 CA--C 1.533 0.319 0 O-C-N 121.14 -0.975 . . . . 0.0 109.845 172.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -54.43 -49.29 70.33 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.985 -0.447 . . . . 0.0 109.91 170.611 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 28.8 mm -58.72 -33.53 49.29 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 O-C-N 121.6 -0.688 . . . . 0.0 110.732 175.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 32.3 m -70.52 -30.27 66.99 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.07 -1.019 . . . . 0.0 111.04 174.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 20.3 t80 -61.03 -55.45 32.65 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 121.096 -1.003 . . . . 0.0 109.169 170.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 44.3 mt -62.36 -40.25 95.8 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 121.118 0.485 . . . . 0.0 111.535 179.19 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -64.35 -43.69 96.49 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 110.643 -0.983 . . . . 0.0 110.643 179.617 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -63.39 -47.8 80.5 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-N 117.497 0.648 . . . . 0.0 110.444 175.628 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 20.3 tp -48.61 -58.98 3.89 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-O 121.402 0.62 . . . . 0.0 110.257 172.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . 0.516 ' HB1' HD11 ' B' ' 13' ' ' ILE . . . -49.77 -54.18 20.58 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 124.381 1.073 . . . . 0.0 110.496 179.328 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 46.9 ttm -57.84 -49.78 75.51 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 123.809 0.844 . . . . 0.0 111.091 -178.316 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 67.0 mt -63.35 -49.56 82.37 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.32 0 CA-C-O 117.942 -1.028 . . . . 0.0 109.932 -174.13 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.451 0.1 OUTLIER -79.46 -37.66 36.4 Favored 'General case' 0 C--N 1.347 0.488 0 CA-C-N 119.733 1.151 . . . . 0.0 113.837 -178.258 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 26.5 m-80 -80.72 75.12 7.64 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 107.691 -1.225 . . . . 0.0 107.691 171.043 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -47.66 -32.45 5.67 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 124.627 1.171 . . . . 0.0 112.684 -175.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -40.87 -38.87 1.02 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.673 1.189 . . . . 0.0 113.171 171.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 43.7 mt -91.1 12.89 18.47 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.939 1.296 . . . . 0.0 113.828 -173.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 19.3 mmtp -65.61 79.39 0.07 Allowed 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 120.14 1.336 . . . . 0.0 113.184 -173.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.16 0 CA-C-O 118.316 -1.269 . . . . 0.0 110.775 174.446 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 28.1 ttt . . . . . 0 N--CA 1.475 0.778 0 CA-C-O 120.494 0.188 . . . . 0.0 110.972 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -69.04 79.97 0.32 Allowed 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 122.854 0.461 . . . . 0.0 110.101 176.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -53.83 159.99 2.38 Favored Pre-proline 0 CA--C 1.539 0.552 0 C-N-CA 124.622 1.169 . . . . 0.0 111.248 176.74 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 77.3 Cg_exo -47.52 -49.62 12.94 Favored 'Trans proline' 0 N--CA 1.459 -0.551 0 C-N-CA 123.305 2.67 . . . . 0.0 112.806 179.801 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.43 HD23 ' HA ' ' B' ' 5' ' ' LEU . 5.2 mt -58.41 -43.88 88.79 Favored 'General case' 0 N--CA 1.455 -0.215 0 CA-C-O 119.094 -0.479 . . . . 0.0 111.788 174.873 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -62.86 -42.06 99.61 Favored 'General case' 0 C--O 1.226 -0.143 0 CA-C-N 119.045 0.838 . . . . 0.0 109.489 -177.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 12.8 tp60 -61.69 -46.75 88.37 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 122.39 0.276 . . . . 0.0 110.853 175.109 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -64.28 -46.8 82.09 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 121.645 0.736 . . . . 0.0 111.275 -177.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 74.8 mt -55.74 -50.92 64.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 N-CA-C 108.35 -0.982 . . . . 0.0 108.35 171.492 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -48.49 -45.89 29.43 Favored Glycine 0 CA--C 1.527 0.787 0 C-N-CA 125.031 1.301 . . . . 0.0 111.468 175.372 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.8 mt -56.27 -57.45 12.18 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 117.613 0.707 . . . . 0.0 110.409 173.284 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.3 mp -57.12 -43.4 82.32 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 119.371 0.987 . . . . 0.0 112.122 -178.225 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . 0.516 HD11 ' HB1' ' A' ' 81' ' ' ALA . 97.2 mt -61.2 -54.08 40.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.242 0 C-N-CA 123.151 0.58 . . . . 0.0 110.679 175.495 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.99 -51.23 55.16 Favored Glycine 0 CA--C 1.522 0.494 0 N-CA-C 109.666 -1.374 . . . . 0.0 109.666 -177.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 8.5 mm -48.04 -54.7 3.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.348 0 C-N-CA 124.279 1.032 . . . . 0.0 110.277 173.03 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -53.29 -62.15 1.84 Allowed 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 121.347 0.594 . . . . 0.0 110.257 -179.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 54.7 t60 -72.63 -12.91 61.24 Favored 'General case' 0 N--CA 1.452 -0.363 0 CA-C-O 118.971 -0.538 . . . . 0.0 112.393 -170.812 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -54.96 -44.48 74.4 Favored 'General case' 0 CA--C 1.531 0.247 0 CA-C-N 119.423 1.01 . . . . 0.0 108.778 169.093 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 64.2 m-85 -94.15 73.07 3.99 Favored 'General case' 0 N--CA 1.454 -0.252 0 N-CA-C 104.9 -2.259 . . . . 0.0 104.9 171.122 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 85.1 p -60.58 69.37 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 127.227 2.211 . . . . 0.0 114.376 -167.678 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . 36.4 47.85 1.16 Allowed Glycine 0 CA--C 1.525 0.685 0 C-N-CA 126.981 2.229 . . . . 0.0 113.79 176.074 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 6.7 mtpm? -57.7 -36.11 71.52 Favored 'General case' 0 N--CA 1.454 -0.259 0 C-N-CA 123.74 0.816 . . . . 0.0 110.992 -169.725 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -78.92 2.03 21.59 Favored 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 113.398 0.888 . . . . 0.0 113.398 -178.163 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . -171.02 -122.83 0.66 Allowed Glycine 0 C--N 1.339 0.698 0 CA-C-N 120.325 1.42 . . . . 0.0 111.861 177.156 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -79.22 149.85 31.78 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 107.085 -1.45 . . . . 0.0 107.085 172.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 10.4 mmpt? -68.11 0.9 3.17 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 -168.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 6.4 p-80 -123.28 23.37 9.11 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.433 1.093 . . . . 0.0 111.58 168.58 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 71.6 p -134.43 145.03 48.5 Favored 'General case' 0 C--O 1.227 -0.089 0 C-N-CA 124.921 1.288 . . . . 0.0 108.246 175.643 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -156.57 163.03 39.84 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-N 119.323 0.965 . . . . 0.0 110.69 -178.092 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 29.9 t -120.99 -168.65 1.7 Allowed 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.635 0.731 . . . . 0.0 110.944 -176.197 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 10.3 pttm -46.99 -50.98 18.22 Favored 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 126.893 2.077 . . . . 0.0 113.131 -171.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -55.48 -52.13 64.66 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-O 120.762 0.315 . . . . 0.0 110.294 -179.132 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -67.04 -35.66 80.37 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-O 118.436 -0.792 . . . . 0.0 111.8 -179.456 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 30.0 mt -64.03 -52.3 60.14 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 119.966 1.257 . . . . 0.0 111.149 175.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 90.4 mttt -56.38 -43.83 79.6 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 122.707 0.403 . . . . 0.0 110.044 177.317 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 65.7 tt0 -54.09 -66.45 0.39 Allowed 'General case' 0 C--O 1.223 -0.334 0 CA-C-O 118.895 -0.574 . . . . 0.0 109.523 171.448 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 3.8 mt -37.54 -60.09 0.72 Allowed 'General case' 0 N--CA 1.462 0.16 0 C-N-CA 125.364 1.465 . . . . 0.0 111.565 179.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 14.3 tt -62.55 -45.2 99.37 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 120.673 -0.411 . . . . 0.0 110.265 -176.094 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 -57.34 -52.96 63.22 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 121.343 -0.848 . . . . 0.0 111.731 177.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 11.4 mmpt? -66.76 -49.29 66.4 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 123.059 0.544 . . . . 0.0 110.497 -174.562 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 70.1 mm-40 -98.06 -16.65 19.51 Favored 'General case' 0 N--CA 1.455 -0.185 0 N-CA-C 115.06 1.504 . . . . 0.0 115.06 -166.77 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 13.5 mt -118.36 79.78 1.43 Allowed 'General case' 0 CA--C 1.523 -0.088 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 171.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 65.7 p -79.13 51.22 1.14 Allowed 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 124.374 1.07 . . . . 0.0 109.445 -178.385 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 27.7 mt -87.88 70.86 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.453 0 N-CA-C 106.536 -1.653 . . . . 0.0 106.536 -179.154 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -54.29 -50.65 55.35 Favored Glycine 0 CA--C 1.527 0.785 0 N-CA-C 109.631 -1.387 . . . . 0.0 109.631 175.022 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 7.1 m -71.24 72.21 0.63 Allowed 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 123.738 0.815 . . . . 0.0 109.299 169.469 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 25.9 mmtp -48.2 93.74 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 125.993 1.717 . . . . 0.0 111.011 -177.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 97.5 mt -44.99 -52.82 8.42 Favored 'General case' 0 CA--C 1.529 0.156 0 C-N-CA 125.479 1.512 . . . . 0.0 113.167 -169.749 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.3 tm0? -161.9 161.86 28.98 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 106.288 -1.745 . . . . 0.0 106.288 -174.589 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -35.67 -42.08 0.23 Allowed 'General case' 0 C--O 1.225 -0.222 0 C-N-CA 128.008 2.523 . . . . 0.0 114.364 -172.032 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.64 -56.25 0.16 Allowed 'General case' 0 CA--C 1.527 0.092 0 C-N-CA 126.118 1.767 . . . . 0.0 114.455 -177.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -67.45 -39.54 85.37 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 120.912 0.387 . . . . 0.0 111.148 -174.436 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 53' ' ' ILE . . . . . 0.56 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.5 mp -61.68 -51.4 73.23 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 176.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 76.9 t -57.34 -42.4 80.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.445 0 C-N-CA 123.938 0.895 . . . . 0.0 110.475 -179.417 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.76 -55.21 37.79 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-N 119.433 1.015 . . . . 0.0 110.443 173.089 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 49.0 mt -53.35 -37.96 62.84 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 122.489 0.316 . . . . 0.0 111.544 -179.55 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.72 -65.56 0.81 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 118.236 0.471 . . . . 0.0 109.961 175.721 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -40.32 -39.88 1.05 Allowed 'General case' 0 N--CA 1.466 0.352 0 C-N-CA 127.489 2.316 . . . . 0.0 111.991 -177.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -37.04 -51.34 0.94 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.172 1.389 . . . . 0.0 111.816 172.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -58.75 -35.64 73.05 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 121.43 -0.794 . . . . 0.0 112.232 -176.591 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -80.75 -49.57 10.98 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 123.141 0.577 . . . . 0.0 109.629 179.385 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 14.8 ttm180 -50.89 -46.72 60.64 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 123.617 0.767 . . . . 0.0 110.164 178.901 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -83.29 20.51 1.29 Allowed 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 123.257 0.623 . . . . 0.0 112.37 -179.104 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -57.86 -41.06 81.64 Favored 'General case' 0 CA--C 1.533 0.289 0 N-CA-C 108.004 -1.109 . . . . 0.0 108.004 167.406 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 7.6 m-20 -82.07 14.6 2.74 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.263 1.025 . . . . 0.0 111.81 173.774 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 41.1 mm-40 56.33 -95.04 0.05 OUTLIER 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 125.874 1.67 . . . . 0.0 112.427 -178.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 50.0 mm-40 -75.25 108.85 8.29 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 124.355 1.062 . . . . 0.0 112.469 -168.215 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 32.7 m -87.13 148.52 4.56 Favored 'Isoleucine or valine' 0 C--O 1.235 0.34 0 N-CA-C 107.483 -1.302 . . . . 0.0 107.483 167.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 15.5 p-10 -91.18 -176.68 4.66 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 123.94 0.896 . . . . 0.0 111.403 177.341 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 53.5 t80 -49.84 -62.09 1.76 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.853 0.861 . . . . 0.0 112.293 177.256 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 41.1 tp60 -60.4 -37.25 80.23 Favored 'General case' 0 CA--C 1.535 0.404 0 CA-C-N 119.299 0.954 . . . . 0.0 111.17 -174.064 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -62.66 -46.07 89.9 Favored 'General case' 0 CA--C 1.534 0.35 0 O-C-N 121.711 -0.618 . . . . 0.0 110.705 175.753 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -55.15 -49.81 70.89 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.846 -0.534 . . . . 0.0 110.148 171.59 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 26.8 mm -56.98 -28.48 28.97 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 O-C-N 121.799 -0.563 . . . . 0.0 110.464 175.425 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 27.8 m -80.96 -24.48 38.07 Favored 'General case' 0 CA--C 1.529 0.171 0 O-C-N 121.301 -0.874 . . . . 0.0 112.986 173.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 41.5 t80 -62.9 -52.74 61.9 Favored 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 107.117 -1.438 . . . . 0.0 107.117 167.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 48.9 mt -62.22 -40.9 97.65 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 120.888 0.375 . . . . 0.0 111.726 175.295 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -60.82 -49.53 77.58 Favored Glycine 0 CA--C 1.521 0.428 0 N-CA-C 110.53 -1.028 . . . . 0.0 110.53 -179.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.49 -47.44 85.66 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 123.155 0.582 . . . . 0.0 110.026 175.801 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 19.5 tp -49.59 -57.22 7.54 Favored 'General case' 0 C--O 1.235 0.312 0 CA-C-O 121.455 0.645 . . . . 0.0 109.853 175.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . 0.415 ' HB1' HD11 ' A' ' 13' ' ' ILE . . . -51.64 -56.47 13.41 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 124.71 1.204 . . . . 0.0 110.55 178.724 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 55.5 ttm -54.56 -46.97 73.75 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.172 0.989 . . . . 0.0 111.177 -178.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 48.1 mt -66.52 -52.86 41.57 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.301 0 CA-C-O 117.922 -1.037 . . . . 0.0 110.399 -175.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.436 0.0 OUTLIER -80.46 -33.59 36.59 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 120.027 1.285 . . . . 0.0 114.141 -176.611 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 22.6 m-80 -81.33 70.03 8.09 Favored 'General case' 0 CA--C 1.523 -0.088 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 170.166 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 3.2 tp10 -42.82 -38.25 2.08 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 126.024 1.73 . . . . 0.0 111.699 -176.134 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -34.02 -47.68 0.28 Allowed 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 126.551 1.94 . . . . 0.0 113.343 170.62 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 64.5 mt -61.64 -28.4 69.35 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.126 0.571 . . . . 0.0 112.443 -177.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -85.89 -49.17 8.08 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 118.336 0.516 . . . . 0.0 109.623 171.311 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.12 0 CA-C-O 117.601 -1.666 . . . . 0.0 110.031 -176.887 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.1 tpt . . . . . 0 N--CA 1.473 0.693 0 N-CA-C 110.434 -0.21 . . . . 0.0 110.434 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -73.24 77.15 1.31 Allowed 'General case' 0 CA--C 1.531 0.223 0 O-C-N 122.047 -0.408 . . . . 0.0 109.916 175.593 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.1 m -51.84 158.19 1.75 Allowed Pre-proline 0 CA--C 1.54 0.558 0 C-N-CA 124.149 0.98 . . . . 0.0 110.802 171.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_exo -48.47 -48.9 15.81 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 122.944 2.429 . . . . 0.0 112.752 -179.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 5.9 mt -59.95 -44.91 94.11 Favored 'General case' 0 C--O 1.224 -0.251 0 CA-C-O 119.299 -0.381 . . . . 0.0 111.328 175.522 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -58.89 -46.82 86.94 Favored 'General case' 0 CA--C 1.528 0.12 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 -178.143 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -57.68 -52.4 65.58 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.383 0.673 . . . . 0.0 110.743 175.76 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.95 -46.2 88.88 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-O 121.407 0.622 . . . . 0.0 111.783 -175.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 71.2 mt -54.65 -51.88 46.69 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.171 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 171.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.55 -48.31 17.06 Favored Glycine 0 CA--C 1.527 0.814 0 C-N-CA 124.725 1.155 . . . . 0.0 111.804 174.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.9 mt -55.74 -56.42 20.65 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 117.613 0.706 . . . . 0.0 111.078 174.365 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.2 mp -58.3 -44.15 88.43 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 118.979 0.809 . . . . 0.0 111.696 -178.362 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 83.3 mt -55.81 -55.14 19.43 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.185 0 C-N-CA 123.316 0.646 . . . . 0.0 109.975 173.283 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.06 -50.03 56.89 Favored Glycine 0 CA--C 1.523 0.592 0 N-CA-C 110.541 -1.024 . . . . 0.0 110.541 -177.563 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 11.7 mm -53.03 -49.2 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.299 0 C-N-CA 123.371 0.668 . . . . 0.0 110.271 175.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -56.4 -62.96 1.36 Allowed 'General case' 0 CA--C 1.531 0.241 0 CA-C-O 121.293 0.568 . . . . 0.0 109.622 177.05 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -51.82 -39.68 59.19 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 124.8 1.24 . . . . 0.0 111.689 -174.049 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.5 tttp -48.97 -39.42 26.49 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 124.079 0.951 . . . . 0.0 111.441 178.01 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 37.5 m-85 -100.01 -59.85 1.64 Allowed 'General case' 0 C--O 1.234 0.261 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 2.6 m -51.11 -45.8 61.66 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 124.049 0.94 . . . . 0.0 111.117 -175.662 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -80.3 23.41 4.0 Favored Glycine 0 C--N 1.336 0.529 0 CA-C-O 118.624 -1.098 . . . . 0.0 113.389 -175.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.7 pttp -148.55 -51.58 0.17 Allowed 'General case' 0 N--CA 1.451 -0.403 0 CA-C-N 118.73 1.265 . . . . 0.0 111.31 168.079 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -101.7 46.58 0.93 Allowed 'General case' 0 CA--C 1.529 0.17 0 C-N-CA 123.648 0.779 . . . . 0.0 109.763 -175.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 166.13 -151.86 20.57 Favored Glycine 0 CA--C 1.523 0.556 0 N-CA-C 105.649 -2.981 . . . . 0.0 105.649 -172.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -114.1 145.74 41.21 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 107.297 -1.372 . . . . 0.0 107.297 168.499 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.59 -20.21 4.85 Favored 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 113.694 0.998 . . . . 0.0 113.694 -177.781 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 1.8 m170 -92.92 -29.9 15.66 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.212 1.005 . . . . 0.0 113.256 176.358 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 60.3 p -144.73 141.39 29.22 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.712 1.205 . . . . 0.0 112.721 -167.613 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -145.64 168.84 19.69 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 123.236 0.614 . . . . 0.0 110.531 176.017 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 72.8 m -111.1 177.05 4.78 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.187 1.395 . . . . 0.0 113.73 -174.148 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 12.5 ptpt -41.92 -53.7 3.72 Favored 'General case' 0 C--N 1.339 0.146 0 C-N-CA 126.602 1.961 . . . . 0.0 114.594 -176.46 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 23.5 ttmm -54.75 -50.09 69.26 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 -177.629 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -58.56 -44.14 89.61 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-O 118.693 -0.67 . . . . 0.0 111.098 177.515 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 90.0 mt -59.02 -51.2 71.09 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 119.17 0.896 . . . . 0.0 111.52 176.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 54.5 mtmt -59.01 -47.66 84.39 Favored 'General case' 0 CA--C 1.531 0.25 0 N-CA-C 109.875 -0.417 . . . . 0.0 109.875 -179.022 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -56.3 -54.15 48.84 Favored 'General case' 0 C--O 1.225 -0.23 0 CA-C-O 119.28 -0.39 . . . . 0.0 110.836 174.105 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 6.6 mt -44.77 -64.4 0.71 Allowed 'General case' 0 CA--C 1.522 -0.109 0 C-N-CA 124.25 1.02 . . . . 0.0 110.425 177.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 18.3 tt -60.24 -49.62 83.47 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 120.174 -0.61 . . . . 0.0 109.989 -175.28 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -55.93 -49.2 74.16 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 123.579 0.752 . . . . 0.0 112.332 -176.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -75.46 -54.4 7.09 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 109.403 -0.592 . . . . 0.0 109.403 -176.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 67.3 mm-40 -73.8 -29.98 62.47 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-O 118.302 -0.856 . . . . 0.0 112.72 -168.322 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 59.7 mt -94.4 95.71 9.04 Favored 'General case' 0 C--N 1.339 0.126 0 N-CA-C 107.221 -1.399 . . . . 0.0 107.221 167.847 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 71.0 p -75.87 60.16 1.32 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.467 1.107 . . . . 0.0 109.251 178.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 28.6 mt -86.91 -58.36 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 C-N-CA 124.501 1.12 . . . . 0.0 109.13 -173.094 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 70.54 -67.69 0.75 Allowed Glycine 0 CA--C 1.531 1.093 0 N-CA-C 110.326 -1.109 . . . . 0.0 110.326 -171.45 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 14.1 m -69.29 73.51 0.33 Allowed 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 125.483 1.513 . . . . 0.0 110.977 175.371 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.431 ' HB3' HD11 ' A' ' 53' ' ' ILE . 50.2 mmtm -28.72 88.89 0.0 OUTLIER 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 128.668 2.787 . . . . 0.0 113.31 178.44 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 92.9 mt -60.32 118.93 7.02 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.04 0.936 . . . . 0.0 113.273 -169.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 23.9 tt0 65.41 -71.46 0.08 Allowed 'General case' 0 CA--C 1.529 0.172 0 C-N-CA 127.125 2.17 . . . . 0.0 114.098 168.047 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -179.9 -42.94 0.01 OUTLIER 'General case' 0 C--O 1.227 -0.128 0 C-N-CA 125.145 1.378 . . . . 0.0 109.339 -168.174 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -38.54 -61.47 0.7 Allowed 'General case' 0 N--CA 1.455 -0.205 0 C-N-CA 125.035 1.334 . . . . 0.0 112.938 -176.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 58.6 tt0 -61.22 -37.82 84.39 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 123.047 0.539 . . . . 0.0 110.89 -175.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.501 ' CD1' ' H ' ' A' ' 53' ' ' ILE . 0.9 OUTLIER -62.55 -54.18 37.33 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 N-CA-C 105.974 -1.862 . . . . 0.0 105.974 -178.926 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 59.9 t -54.94 -39.76 50.46 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 CA-C-O 118.118 -0.944 . . . . 0.0 110.702 176.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 12.6 mmmt -59.96 -51.53 69.27 Favored 'General case' 0 C--O 1.231 0.12 0 CA-C-N 120.226 1.376 . . . . 0.0 110.414 176.292 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 85.1 mt -57.34 -37.6 72.8 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 119.322 -0.371 . . . . 0.0 110.828 -179.474 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 24.0 mmt -70.34 -62.85 1.23 Allowed 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 118.59 0.632 . . . . 0.0 109.992 175.503 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -44.29 -42.47 6.71 Favored 'General case' 0 CA--C 1.52 -0.19 0 C-N-CA 127.472 2.309 . . . . 0.0 111.425 -176.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -38.0 -50.87 1.36 Allowed 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.087 1.355 . . . . 0.0 111.391 174.178 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 71.1 mt -60.54 -35.78 76.85 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 121.924 -0.485 . . . . 0.0 111.667 -175.514 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -80.81 -54.76 5.32 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 123.437 0.695 . . . . 0.0 109.824 179.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 14.7 ttm180 -45.45 -49.8 13.13 Favored 'General case' 0 N--CA 1.455 -0.178 0 C-N-CA 124.473 1.109 . . . . 0.0 110.044 177.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -87.26 26.84 1.14 Allowed 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 112.54 0.57 . . . . 0.0 112.54 -174.058 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 28.5 mtmm -57.19 -36.54 70.95 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 120.016 1.28 . . . . 0.0 109.101 167.351 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -73.29 6.87 2.56 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.129 0.972 . . . . 0.0 112.652 173.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 33.6 mt-30 66.14 -74.97 0.06 Allowed 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 126.378 1.871 . . . . 0.0 110.408 -174.2 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -82.05 150.5 27.53 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 124.766 1.226 . . . . 0.0 111.587 -173.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 23.4 m -130.86 147.2 33.1 Favored 'Isoleucine or valine' 0 C--O 1.236 0.353 0 N-CA-C 105.65 -1.981 . . . . 0.0 105.65 166.641 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -88.53 168.29 12.71 Favored 'General case' 0 C--O 1.232 0.164 0 C-N-CA 122.719 0.408 . . . . 0.0 111.194 175.832 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -33.45 -61.55 0.31 Allowed 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.722 1.209 . . . . 0.0 112.854 171.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 38.6 tp60 -61.92 -33.27 73.94 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-N 119.794 1.179 . . . . 0.0 112.042 -174.673 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -70.18 -40.01 74.92 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.249 -0.907 . . . . 0.0 110.095 177.076 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -56.92 -48.5 78.11 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 169.967 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . 0.403 ' CG2' ' CG2' ' B' ' 74' ' ' ILE . 27.3 mm -58.23 -36.64 58.62 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.255 0 O-C-N 121.535 -0.728 . . . . 0.0 110.006 175.701 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 42.5 m -64.35 -38.54 91.4 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.931 0.787 . . . . 0.0 110.489 174.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 18.6 t80 -55.88 -55.41 32.89 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 172.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 36.3 mt -59.37 -41.98 90.58 Favored 'General case' 0 CA--C 1.533 0.299 0 O-C-N 121.987 -0.445 . . . . 0.0 112.133 178.262 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -68.38 -39.96 87.21 Favored Glycine 0 CA--C 1.523 0.593 0 N-CA-C 110.638 -0.985 . . . . 0.0 110.638 -175.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.01 -50.03 67.87 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-N 117.597 0.699 . . . . 0.0 109.938 173.758 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -47.92 -56.84 6.64 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 123.988 0.915 . . . . 0.0 110.05 175.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -50.86 -62.5 1.57 Allowed 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 124.677 1.191 . . . . 0.0 110.327 175.081 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 6.5 ttp -54.92 -37.94 67.02 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.121 0.569 . . . . 0.0 112.039 -173.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 73.6 mt -69.82 -57.84 7.16 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 CA-C-O 117.975 -1.012 . . . . 0.0 110.877 178.083 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.438 0.2 OUTLIER -77.76 -35.14 52.05 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 120.313 1.415 . . . . 0.0 113.814 -174.208 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 19.3 m120 -80.55 58.79 3.32 Favored 'General case' 0 CA--C 1.535 0.379 0 N-CA-C 106.425 -1.694 . . . . 0.0 106.425 168.535 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -47.09 -35.22 6.74 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 126.769 2.028 . . . . 0.0 113.505 -167.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -43.12 -36.95 1.85 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.706 1.203 . . . . 0.0 112.953 175.043 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 34.0 mt -55.02 -34.83 63.8 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 112.526 0.565 . . . . 0.0 112.526 178.011 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -78.34 56.51 1.74 Allowed 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 119.185 0.902 . . . . 0.0 111.042 -178.172 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.338 0 CA-C-O 117.423 -1.765 . . . . 0.0 111.109 174.572 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 21.7 ptm . . . . . 0 N--CA 1.479 0.993 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -73.3 75.36 1.34 Allowed 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.111 0.564 . . . . 0.0 110.189 179.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.09 165.55 1.39 Allowed Pre-proline 0 CA--C 1.537 0.471 0 C-N-CA 125.53 1.532 . . . . 0.0 111.756 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_exo -46.14 -50.77 9.5 Favored 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 123.528 2.819 . . . . 0.0 113.052 177.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' B' ' 5' ' ' LEU . 6.0 mt -55.9 -52.51 63.85 Favored 'General case' 0 C--N 1.34 0.175 0 O-C-N 122.328 -0.233 . . . . 0.0 111.115 175.109 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -58.78 -43.59 90.49 Favored 'General case' 0 C--O 1.225 -0.201 0 N-CA-C 110.118 -0.326 . . . . 0.0 110.118 -175.217 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.1 tp-100 -61.94 -49.72 75.0 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 124.147 0.979 . . . . 0.0 110.441 177.534 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -62.87 -44.2 96.74 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.039 0.536 . . . . 0.0 111.222 -178.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 71.3 mt -54.4 -53.31 31.42 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.205 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 169.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -44.97 -48.25 9.45 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 124.947 1.261 . . . . 0.0 111.923 174.436 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 4.0 mt -56.61 -57.93 10.24 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-N 117.679 0.739 . . . . 0.0 110.895 174.199 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 10.0 mp -56.41 -42.77 78.54 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 119.483 1.038 . . . . 0.0 111.75 -178.35 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 71.6 mt -59.3 -55.25 24.87 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.239 0 C-N-CA 123.508 0.723 . . . . 0.0 110.779 174.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -55.91 -48.99 69.12 Favored Glycine 0 CA--C 1.523 0.549 0 N-CA-C 110.198 -1.161 . . . . 0.0 110.198 -177.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 9.5 mm -51.25 -49.81 28.97 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.391 0 C-N-CA 124.34 1.056 . . . . 0.0 110.103 173.687 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -56.18 -61.64 2.26 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.082 0.468 . . . . 0.0 109.772 177.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 13.5 m-70 -53.0 -37.09 61.16 Favored 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 123.936 0.894 . . . . 0.0 112.812 -176.679 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 62.3 tttm -47.12 -35.67 7.45 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.904 0.881 . . . . 0.0 111.368 175.862 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -102.95 -66.99 0.9 Allowed 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 173.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -52.99 -41.08 64.27 Favored 'General case' 0 C--O 1.227 -0.111 0 C-N-CA 123.899 0.88 . . . . 0.0 112.152 -170.726 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -54.7 -15.09 5.8 Favored Glycine 0 CA--C 1.527 0.793 0 CA-C-O 118.486 -1.175 . . . . 0.0 113.949 -179.009 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.61 -50.36 0.61 Allowed 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 118.978 1.389 . . . . 0.0 111.779 170.631 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -77.66 70.31 4.02 Favored 'General case' 0 CA--C 1.532 0.273 0 O-C-N 121.282 -0.886 . . . . 0.0 109.6 177.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 134.68 -121.77 2.73 Favored Glycine 0 CA--C 1.521 0.411 0 N-CA-C 107.358 -2.297 . . . . 0.0 107.358 -179.368 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -140.3 153.87 46.61 Favored 'General case' 0 N--CA 1.452 -0.325 0 N-CA-C 106.331 -1.729 . . . . 0.0 106.331 168.78 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -50.17 -21.29 1.26 Allowed 'General case' 0 CA--C 1.542 0.648 0 N-CA-C 113.812 1.041 . . . . 0.0 113.812 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 13.9 t-160 -91.17 -28.79 17.63 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 126.045 1.738 . . . . 0.0 114.308 176.421 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 45.4 p -140.07 148.75 42.22 Favored 'General case' 0 N--CA 1.466 0.347 0 C-N-CA 124.329 1.052 . . . . 0.0 113.804 -168.1 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -151.61 173.44 14.65 Favored 'General case' 0 CA--C 1.527 0.067 0 C-N-CA 123.263 0.625 . . . . 0.0 110.03 171.471 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 22.2 p -117.67 174.24 6.28 Favored 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 124.495 1.118 . . . . 0.0 113.318 -169.539 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 6.6 pttp -34.79 -59.77 0.47 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 126.867 2.067 . . . . 0.0 112.986 175.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 35.3 tptt -44.87 -49.51 10.87 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 124.558 1.143 . . . . 0.0 111.797 176.597 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -70.34 -36.0 73.94 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 122.902 0.481 . . . . 0.0 110.632 -176.329 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 34.6 mt -64.33 -46.66 82.54 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.647 0.658 . . . . 0.0 110.789 174.673 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 68.9 mttm -55.6 -51.87 65.7 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 174.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 68.3 mt-10 -56.51 -47.43 79.36 Favored 'General case' 0 C--O 1.218 -0.56 0 CA-C-O 118.969 -0.539 . . . . 0.0 110.856 176.073 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 8.5 mt -51.0 -53.22 35.23 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 119.574 1.079 . . . . 0.0 110.464 179.339 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 1.4 mp -56.09 -58.61 4.51 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 174.597 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -55.23 -43.93 75.01 Favored 'General case' 0 CA--C 1.537 0.456 0 N-CA-C 112.6 0.593 . . . . 0.0 112.6 -172.254 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 6.9 mmpt? -83.11 -54.59 4.93 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 125.667 1.587 . . . . 0.0 109.916 -172.662 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 44.7 mm-40 -94.42 -17.26 22.68 Favored 'General case' 0 N--CA 1.456 -0.161 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 -167.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 67.4 mt -118.54 69.82 0.8 Allowed 'General case' 0 N--CA 1.457 -0.082 0 C-N-CA 123.907 0.883 . . . . 0.0 108.997 170.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 14.3 p -57.6 -38.18 74.49 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 168.272 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . 0.289 4.4 tt 60.03 -50.72 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 130.182 3.393 . . . . 0.0 116.874 167.55 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 134.19 -152.15 20.5 Favored Glycine 0 CA--C 1.523 0.552 0 N-CA-C 106.142 -2.783 . . . . 0.0 106.142 -169.535 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 3.9 m -75.04 58.56 0.88 Allowed 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 117.806 0.803 . . . . 0.0 112.521 -177.117 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 22.3 mmtm 43.53 70.26 0.33 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.66 1.584 . . . . 0.0 110.581 178.257 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 16.7 mt -58.33 83.16 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.258 1.423 . . . . 0.0 113.352 -169.246 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 82.37 153.93 0.11 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 127.137 2.175 . . . . 0.0 111.225 173.44 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -42.24 -38.34 1.74 Allowed 'General case' 0 C--O 1.226 -0.142 0 C-N-CA 127.236 2.214 . . . . 0.0 113.523 -170.307 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.49 -60.31 0.15 Allowed 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 126.076 1.75 . . . . 0.0 113.344 -179.195 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -69.75 -36.84 76.15 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 122.248 0.219 . . . . 0.0 111.194 -172.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 53' ' ' ILE . . . . . 0.517 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.3 mp -62.86 -55.3 24.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 N-CA-C 106.993 -1.484 . . . . 0.0 106.993 178.455 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 78.3 t -55.84 -46.01 79.9 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.361 0 C-N-CA 124.709 1.204 . . . . 0.0 110.015 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 5.0 mptp? -53.6 -53.47 51.28 Favored 'General case' 0 N--CA 1.455 -0.177 0 CA-C-N 118.216 0.462 . . . . 0.0 110.791 173.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 68.7 mt -56.53 -43.86 80.26 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 119.116 -0.468 . . . . 0.0 111.452 178.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 25.7 mmt -62.42 -59.27 5.22 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 118.816 0.734 . . . . 0.0 109.393 178.765 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 75.1 m-20 -54.22 -40.76 67.97 Favored 'General case' 0 N--CA 1.457 -0.112 0 C-N-CA 125.303 1.441 . . . . 0.0 111.007 -175.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -38.93 -50.97 1.78 Allowed 'General case' 0 C--O 1.232 0.158 0 C-N-CA 125.747 1.619 . . . . 0.0 112.555 -173.794 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 3.0 pp -58.86 -39.26 80.81 Favored 'General case' 0 CA--C 1.532 0.288 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 -176.127 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -77.0 -45.7 26.42 Favored 'General case' 0 N--CA 1.456 -0.157 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 177.51 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 23.4 ttm-85 -48.93 -44.53 40.55 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 123.532 0.733 . . . . 0.0 109.979 179.086 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 -86.31 34.89 0.64 Allowed 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.1 0.56 . . . . 0.0 111.86 179.561 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -55.2 -32.57 62.33 Favored 'General case' 0 CA--C 1.536 0.408 0 O-C-N 121.11 -0.994 . . . . 0.0 110.416 168.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -79.72 13.08 2.25 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 124.371 1.068 . . . . 0.0 112.566 174.409 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 11.2 tp-100 68.75 -61.61 0.41 Allowed 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 127.348 2.259 . . . . 0.0 112.386 -177.187 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -110.99 158.34 18.89 Favored 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 124.326 1.051 . . . . 0.0 111.818 -177.468 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 36.0 m -124.9 152.39 31.19 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.449 0 C-N-CA 126.607 1.963 . . . . 0.0 106.081 167.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 10.6 p30 -91.5 169.23 10.94 Favored 'General case' 0 C--O 1.233 0.205 0 C-N-CA 123.156 0.582 . . . . 0.0 110.54 175.389 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 60.7 t80 -35.58 -60.67 0.5 Allowed 'General case' 0 CA--C 1.532 0.262 0 C-N-CA 125.125 1.37 . . . . 0.0 113.243 177.019 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 37.9 tp60 -63.88 -31.46 72.65 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 119.752 1.16 . . . . 0.0 111.294 -173.012 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -74.67 -36.39 62.8 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 121.56 -0.712 . . . . 0.0 110.186 177.848 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -56.86 -49.59 75.04 Favored 'General case' 0 CA--C 1.536 0.41 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 168.363 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . 0.403 ' CG2' ' CG2' ' A' ' 74' ' ' ILE . 24.2 mm -57.38 -39.1 66.24 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.339 0 O-C-N 121.963 -0.461 . . . . 0.0 110.012 175.821 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 55.3 m -62.45 -40.82 97.85 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 118.946 0.793 . . . . 0.0 110.608 175.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 12.0 t80 -53.37 -55.98 20.53 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 173.492 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 51.0 mt -61.16 -40.86 95.45 Favored 'General case' 0 CA--C 1.532 0.255 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 179.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -70.26 -43.87 61.7 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 110.788 -0.925 . . . . 0.0 110.788 -174.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -64.5 -46.89 81.01 Favored 'General case' 0 N--CA 1.454 -0.272 0 CA-C-N 117.705 0.752 . . . . 0.0 109.894 174.466 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 12.2 tp -49.7 -56.05 11.58 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-O 121.419 0.628 . . . . 0.0 109.559 174.274 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.08 -53.63 40.01 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.882 1.273 . . . . 0.0 110.802 177.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 52.9 ttm -54.11 -49.58 68.8 Favored 'General case' 0 N--CA 1.454 -0.258 0 C-N-CA 124.31 1.044 . . . . 0.0 110.552 -179.65 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 76.4 mt -62.54 -59.19 4.75 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.33 0 CA-C-O 118.701 -0.666 . . . . 0.0 109.586 -176.475 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.388 0.1 OUTLIER -71.25 -35.11 71.3 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 118.467 -1.293 . . . . 0.0 112.938 -174.365 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 37.3 m-80 -81.07 72.08 8.08 Favored 'General case' 0 N--CA 1.462 0.16 0 O-C-N 120.793 -1.192 . . . . 0.0 108.157 170.507 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -43.81 -34.45 1.58 Allowed 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 124.918 1.287 . . . . 0.0 112.725 -179.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -41.1 -42.82 2.08 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.876 1.27 . . . . 0.0 113.189 173.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 96.1 mt -72.37 -18.06 61.77 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 123.409 0.684 . . . . 0.0 112.718 -177.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -92.36 -43.76 9.07 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 123.714 0.806 . . . . 0.0 109.933 173.036 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.177 0 CA-C-O 116.583 -2.232 . . . . 0.0 110.093 -179.145 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.474 0.736 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -78.63 73.79 5.18 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 121.192 0.52 . . . . 0.0 111.085 -174.586 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -61.34 167.79 3.7 Favored Pre-proline 0 CA--C 1.534 0.347 0 C-N-CA 124.795 1.238 . . . . 0.0 111.339 172.878 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_endo -49.63 -45.05 33.08 Favored 'Trans proline' 0 N--CA 1.456 -0.691 0 C-N-CA 122.926 2.417 . . . . 0.0 111.428 171.28 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.415 HD23 ' HA ' ' A' ' 5' ' ' LEU . 4.1 mt -53.74 -57.35 11.15 Favored 'General case' 0 C--O 1.224 -0.283 0 CA-C-N 118.02 0.373 . . . . 0.0 111.317 171.606 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -56.84 -42.23 79.29 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.176 0.444 . . . . 0.0 110.831 -174.999 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 17.3 tt0 -59.74 -50.71 72.76 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.54 0.736 . . . . 0.0 110.842 175.509 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.01 -45.96 83.37 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.577 0.751 . . . . 0.0 111.632 -176.462 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 87.1 mt -53.48 -51.02 45.67 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 169.887 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.04 -49.03 18.91 Favored Glycine 0 CA--C 1.528 0.88 0 C-N-CA 124.923 1.249 . . . . 0.0 112.005 173.55 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 mt -56.82 -55.16 37.89 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-N 117.947 0.873 . . . . 0.0 110.864 174.893 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.0 mp -57.49 -43.6 84.27 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 119.136 0.88 . . . . 0.0 111.38 -179.024 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 95.4 mt -58.32 -53.11 50.65 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.193 0 C-N-CA 123.497 0.719 . . . . 0.0 110.362 174.207 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.42 -49.66 67.53 Favored Glycine 0 CA--C 1.524 0.596 0 N-CA-C 110.322 -1.111 . . . . 0.0 110.322 -177.953 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 9.6 mm -53.32 -48.52 55.91 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 C-N-CA 123.572 0.749 . . . . 0.0 109.885 174.91 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 53.1 t80 -56.09 -61.13 2.59 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.258 0.481 . . . . 0.0 110.056 176.921 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -51.06 -39.69 56.56 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 125.74 1.616 . . . . 0.0 111.503 -176.27 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -50.93 -36.17 37.18 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.715 0.806 . . . . 0.0 111.506 178.913 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -107.05 -38.21 6.09 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.078 0.551 . . . . 0.0 111.654 -177.929 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 59.6 p -73.88 -37.38 64.74 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-N 118.801 0.728 . . . . 0.0 111.772 -178.749 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -72.35 64.63 1.35 Allowed Glycine 0 C--N 1.34 0.753 0 C-N-CA 125.326 1.441 . . . . 0.0 111.788 -171.078 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 3.1 ptpp? 178.39 -33.37 0.01 OUTLIER 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 127.51 2.324 . . . . 0.0 110.241 -174.739 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -77.04 47.16 0.52 Allowed 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 119.002 0.819 . . . . 0.0 112.041 -177.867 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 61.64 -81.12 0.02 OUTLIER Glycine 0 CA--C 1.528 0.888 0 C-N-CA 124.688 1.137 . . . . 0.0 111.753 -179.118 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 48.6 t0 -80.03 95.08 6.06 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 176.493 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 51.0 mttp -67.65 -10.1 49.19 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.159 0.984 . . . . 0.0 112.818 -172.217 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 20.6 t-160 -77.87 -11.16 59.87 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.262 1.425 . . . . 0.0 111.066 172.077 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.3 p -123.13 156.57 34.75 Favored 'General case' 0 CA--C 1.529 0.167 0 C-N-CA 124.116 0.966 . . . . 0.0 111.841 179.605 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -150.21 161.58 42.14 Favored 'General case' 0 CA--C 1.528 0.109 0 C-N-CA 123.034 0.534 . . . . 0.0 111.177 168.649 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 83.7 p -87.07 164.74 16.27 Favored 'General case' 0 N--CA 1.455 -0.184 0 N-CA-C 115.638 1.718 . . . . 0.0 115.638 -168.063 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 20.7 ttmm -42.6 -54.17 4.09 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 126.878 2.071 . . . . 0.0 109.442 166.685 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 22.4 ttmm -58.01 -54.27 48.79 Favored 'General case' 0 N--CA 1.447 -0.594 0 C-N-CA 124.075 0.95 . . . . 0.0 109.782 179.247 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -60.12 -34.19 73.17 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 118.91 -0.567 . . . . 0.0 111.746 -177.49 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 44.0 mt -65.61 -52.71 49.95 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 119.276 0.943 . . . . 0.0 111.345 173.999 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -60.45 -35.96 77.08 Favored 'General case' 0 CA--C 1.532 0.261 0 O-C-N 122.3 -0.25 . . . . 0.0 110.439 -179.43 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 88.4 mt-10 -60.13 -68.71 0.27 Allowed 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 108.424 -0.954 . . . . 0.0 108.424 168.383 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.5 mt -32.57 -61.65 0.26 Allowed 'General case' 0 N--CA 1.464 0.248 0 C-N-CA 125.94 1.696 . . . . 0.0 112.388 -177.965 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.3 tt -57.14 -52.19 59.41 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 N-CA-C 110.337 -0.246 . . . . 0.0 110.337 -174.844 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 19.0 tt0 -64.33 -44.99 89.81 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 121.905 -0.497 . . . . 0.0 111.643 -177.874 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.0 mmpt? -64.6 -51.35 63.16 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 124.894 1.278 . . . . 0.0 110.219 -175.619 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 65.1 mm-40 -90.24 -47.52 7.73 Favored 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 123.483 0.713 . . . . 0.0 111.582 -168.911 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 18.1 mt -83.17 63.41 7.16 Favored 'General case' 0 C--N 1.339 0.122 0 CA-C-N 118.976 0.807 . . . . 0.0 110.386 -177.828 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 53.2 p -74.83 69.06 1.81 Allowed 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 105.163 -2.162 . . . . 0.0 105.163 167.412 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.496 HG23 ' O ' ' A' ' 46' ' ' SER . 10.5 tt -81.81 49.44 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 124.21 1.004 . . . . 0.0 111.43 -166.982 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.65 -64.0 1.48 Allowed Glycine 0 CA--C 1.53 1.019 0 N-CA-C 110.134 -1.186 . . . . 0.0 110.134 -170.858 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.496 ' O ' HG23 ' A' ' 44' ' ' ILE . 36.4 t -158.9 -172.35 3.77 Favored 'General case' 0 N--CA 1.454 -0.231 0 N-CA-C 106.394 -1.706 . . . . 0.0 106.394 169.736 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 39.1 mmtm -72.31 74.57 1.0 Allowed 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 123.291 0.636 . . . . 0.0 109.718 179.276 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 36.0 mt -52.28 -46.85 66.04 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 123.697 0.799 . . . . 0.0 112.962 -170.372 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 tm0? -156.26 149.93 24.86 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.769 -0.456 . . . . 0.0 109.769 -172.2 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -20.74 -48.42 0.01 OUTLIER 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 130.723 3.609 . . . . 0.0 116.066 179.108 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -33.03 -59.06 0.36 Allowed 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 125.591 1.556 . . . . 0.0 113.396 -179.454 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -64.94 -36.88 85.8 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 121.255 0.55 . . . . 0.0 110.775 -173.815 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.499 ' CD1' ' H ' ' A' ' 53' ' ' ILE . 0.8 OUTLIER -65.56 -53.94 33.67 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.572 0 N-CA-C 106.485 -1.672 . . . . 0.0 106.485 -178.068 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 75.4 t -57.91 -43.82 85.34 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 CA-C-O 118.633 -0.698 . . . . 0.0 110.451 178.86 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -54.72 -53.7 51.54 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 119.385 0.993 . . . . 0.0 110.459 174.301 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 20.6 mt -52.83 -44.26 66.58 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 119.104 -0.474 . . . . 0.0 111.404 178.651 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 25.9 mmt -66.84 -66.15 0.59 Allowed 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 118.529 0.604 . . . . 0.0 109.456 177.632 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -40.46 -42.68 1.67 Allowed 'General case' 0 CA--C 1.519 -0.243 0 C-N-CA 127.803 2.441 . . . . 0.0 111.648 -176.738 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -39.22 -47.7 1.68 Allowed 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 123.862 0.865 . . . . 0.0 112.72 178.042 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -64.35 -37.22 86.75 Favored 'General case' 0 CA--C 1.532 0.253 0 CA-C-N 118.044 0.384 . . . . 0.0 111.385 -176.162 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -78.87 -36.88 41.52 Favored 'General case' 0 N--CA 1.457 -0.102 0 C-N-CA 123.841 0.856 . . . . 0.0 110.104 -178.284 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 15.2 ttm180 -60.8 -52.33 65.52 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 174.448 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 9.3 m-80 -81.44 47.23 1.02 Allowed 'General case' 0 CA--C 1.531 0.215 0 O-C-N 121.876 -0.515 . . . . 0.0 111.564 -174.346 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 36.4 mttp -59.23 -42.52 91.23 Favored 'General case' 0 CA--C 1.531 0.239 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 167.832 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -76.08 12.07 1.27 Allowed 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.227 1.011 . . . . 0.0 112.534 173.727 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 78.1 mm-40 70.62 -35.58 0.33 Allowed 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 126.183 1.793 . . . . 0.0 114.781 175.292 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 21.3 mt-10 -124.43 165.43 17.76 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 124.761 1.225 . . . . 0.0 111.803 176.483 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 16.3 m -128.04 157.17 40.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.279 0 C-N-CA 125.325 1.45 . . . . 0.0 107.787 168.62 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -87.18 171.28 10.79 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.048 0.939 . . . . 0.0 111.495 173.522 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 68.8 t80 -44.45 -62.43 1.18 Allowed 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 123.945 0.898 . . . . 0.0 113.141 176.172 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 37.0 tp60 -61.61 -34.48 75.73 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 119.722 1.146 . . . . 0.0 110.89 -174.795 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 83.5 mt-10 -64.45 -41.06 96.76 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 121.445 -0.784 . . . . 0.0 110.925 175.029 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -57.47 -47.97 80.44 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 121.606 -0.684 . . . . 0.0 109.899 169.824 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 31.0 mm -60.35 -29.56 44.48 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 O-C-N 121.503 -0.748 . . . . 0.0 110.767 175.281 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 29.2 m -69.93 -40.74 75.34 Favored 'General case' 0 C--O 1.225 -0.196 0 O-C-N 121.215 -0.928 . . . . 0.0 110.197 173.413 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 41.0 t80 -56.67 -53.67 54.95 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 121.571 -0.706 . . . . 0.0 109.576 173.413 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 61.2 mt -63.24 -41.12 99.04 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 121.947 -0.471 . . . . 0.0 111.988 178.437 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.79 -41.26 95.77 Favored Glycine 0 CA--C 1.526 0.724 0 N-CA-C 110.737 -0.945 . . . . 0.0 110.737 -179.076 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.34 -46.99 87.93 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 123.269 0.627 . . . . 0.0 110.127 173.453 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 9.8 tp -51.96 -58.3 6.92 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.714 0.768 . . . . 0.0 109.774 175.402 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -47.83 -53.39 15.72 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 114.486 -1.234 . . . . 0.0 110.089 178.077 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 46.0 ttm -57.59 -51.92 67.51 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 123.684 0.794 . . . . 0.0 111.343 -179.437 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 85.6 mt -61.7 -45.13 99.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 CA-C-O 118.229 -0.891 . . . . 0.0 110.613 -173.712 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.457 0.1 OUTLIER -83.08 -33.99 26.27 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 179.982 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 36.1 m-80 -84.66 85.57 7.42 Favored 'General case' 0 N--CA 1.463 0.222 0 O-C-N 120.845 -1.159 . . . . 0.0 108.93 173.958 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -36.89 -42.06 0.37 Allowed 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.654 1.181 . . . . 0.0 113.356 171.741 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -55.33 -17.07 4.12 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 125.298 1.439 . . . . 0.0 114.304 -179.516 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 69.8 mt -108.9 10.14 26.5 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.608 1.163 . . . . 0.0 112.616 -179.114 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 25.9 mmtp -66.72 78.22 0.11 Allowed 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 119.702 1.137 . . . . 0.0 111.77 -179.791 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.239 0 CA-C-O 117.452 -1.749 . . . . 0.0 110.105 177.241 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 57.7 ttp . . . . . 0 N--CA 1.474 0.749 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -74.24 77.87 1.81 Allowed 'General case' 0 C--O 1.235 0.299 0 N-CA-C 110.135 -0.32 . . . . 0.0 110.135 177.958 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -49.54 155.32 1.38 Allowed Pre-proline 0 CA--C 1.535 0.386 0 C-N-CA 125.354 1.462 . . . . 0.0 109.959 172.189 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_exo -43.76 -52.72 5.09 Favored 'Trans proline' 0 N--CA 1.46 -0.487 0 C-N-CA 123.38 2.72 . . . . 0.0 113.165 -177.141 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 5.2 mt -55.44 -55.62 29.57 Favored 'General case' 0 C--O 1.226 -0.153 0 N-CA-C 112.46 0.541 . . . . 0.0 112.46 173.514 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -58.18 -38.17 76.15 Favored 'General case' 0 C--O 1.225 -0.233 0 CA-C-N 118.301 0.5 . . . . 0.0 110.332 -175.048 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -68.55 -49.19 61.39 Favored 'General case' 0 N--CA 1.449 -0.51 0 C-N-CA 125.088 1.355 . . . . 0.0 110.155 -179.313 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -60.35 -47.39 86.25 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.553 0.741 . . . . 0.0 110.648 177.991 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 70.0 mt -52.48 -53.86 17.9 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 169.956 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.84 -44.24 17.63 Favored Glycine 0 CA--C 1.526 0.736 0 C-N-CA 125.752 1.644 . . . . 0.0 112.322 175.977 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.68 -53.01 62.96 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.809 0.844 . . . . 0.0 110.686 174.683 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 11.0 mp -58.25 -41.43 84.2 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-N 119.01 0.823 . . . . 0.0 111.395 178.008 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 84.6 mt -60.29 -51.7 69.91 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 C-N-CA 123.651 0.78 . . . . 0.0 110.735 174.563 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -56.48 -49.21 70.74 Favored Glycine 0 CA--C 1.521 0.445 0 N-CA-C 109.685 -1.366 . . . . 0.0 109.685 -179.083 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 10.2 mm -54.42 -46.41 70.36 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 C-N-CA 123.139 0.576 . . . . 0.0 110.409 174.594 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 58.5 t80 -55.27 -62.65 1.53 Allowed 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 118.974 0.806 . . . . 0.0 109.949 175.205 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -53.15 -38.42 62.72 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 124.329 1.052 . . . . 0.0 111.66 -175.092 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -47.86 -38.39 16.06 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 124.059 0.944 . . . . 0.0 111.391 176.986 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 44.4 m-85 -99.35 -59.09 1.79 Allowed 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 109.184 -0.673 . . . . 0.0 109.184 177.343 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 4.7 m -51.49 -37.1 47.47 Favored 'General case' 0 C--O 1.227 -0.1 0 C-N-CA 124.215 1.006 . . . . 0.0 112.507 -175.019 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -40.95 -47.47 4.14 Favored Glycine 0 CA--C 1.527 0.836 0 C-N-CA 124.018 0.818 . . . . 0.0 111.728 173.856 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 59.2 mttm -66.18 -23.07 66.39 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 112.019 0.377 . . . . 0.0 112.019 -173.782 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -73.84 -11.56 60.41 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.098 0.559 . . . . 0.0 111.622 179.427 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 76.76 -59.59 3.41 Favored Glycine 0 CA--C 1.529 0.946 0 N-CA-C 110.182 -1.167 . . . . 0.0 110.182 -176.506 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 62.6 t0 -77.81 63.24 2.82 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 107.562 -1.273 . . . . 0.0 107.562 171.131 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 63.8 pttt -71.78 7.33 1.57 Allowed 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 114.797 1.406 . . . . 0.0 114.797 -168.523 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 3.8 m80 -77.62 -22.49 50.67 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 168.608 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 2.4 p -122.56 167.32 13.52 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 127.232 2.213 . . . . 0.0 110.381 -179.888 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -152.53 163.52 39.42 Favored 'General case' 0 N--CA 1.455 -0.191 0 C-N-CA 123.771 0.829 . . . . 0.0 109.523 167.568 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 14.5 m -84.98 147.17 26.84 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.265 1.026 . . . . 0.0 110.241 176.987 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 22.1 pttp -53.7 -31.43 47.97 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 113.739 1.014 . . . . 0.0 113.739 -175.176 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.4 tmmt? -50.34 -43.52 54.1 Favored 'General case' 0 CA--C 1.535 0.379 0 O-C-N 121.884 -0.51 . . . . 0.0 110.184 172.024 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -65.89 -29.68 70.15 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-O 117.847 -1.073 . . . . 0.0 111.794 177.107 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . . . . . . . . . 89.5 mt -65.5 -48.88 71.05 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 120.522 1.51 . . . . 0.0 109.299 174.409 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 59.4 mtmt -60.5 -44.78 95.62 Favored 'General case' 0 CA--C 1.533 0.29 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.228 179.789 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 72.7 mt-10 -55.07 -66.52 0.39 Allowed 'General case' 0 C--O 1.219 -0.536 0 CA-C-O 118.552 -0.737 . . . . 0.0 109.585 170.252 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 9.4 mt -35.93 -60.56 0.53 Allowed 'General case' 0 C--O 1.23 0.065 0 C-N-CA 125.294 1.437 . . . . 0.0 111.475 -179.82 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 1.5 tp -60.36 -51.68 70.16 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.471 0 C-N-CA 120.705 -0.398 . . . . 0.0 110.103 -174.605 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -66.07 -44.75 83.6 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.728 0.694 . . . . 0.0 111.986 -175.463 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 6.9 mmpt? -61.87 -58.89 6.21 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 125.4 1.48 . . . . 0.0 109.26 -179.138 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -79.46 -54.76 5.6 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-N 115.782 -0.644 . . . . 0.0 109.3 -170.069 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 42.1 mt -83.91 63.15 7.4 Favored 'General case' 0 C--N 1.334 -0.084 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 172.291 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 3.0 t -75.17 55.89 0.77 Allowed 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 123.997 0.919 . . . . 0.0 109.435 172.994 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . . 76.2 mt -74.02 84.41 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.526 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 -178.505 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . -68.69 70.55 0.39 Allowed Glycine 0 CA--C 1.531 1.073 0 C-N-CA 124.099 0.857 . . . . 0.0 111.65 177.461 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 19.6 m 140.47 72.32 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.28 0 C-N-CA 131.518 3.927 . . . . 0.0 106.03 -174.064 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . . . . . . . . . 37.6 mttt -61.67 98.43 0.09 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.201 0.6 . . . . 0.0 111.02 -169.866 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 88.4 mt -40.39 -41.74 1.44 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 127.296 2.238 . . . . 0.0 115.437 -170.466 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -155.13 162.85 40.88 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 105.694 -1.965 . . . . 0.0 105.694 -171.515 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -49.08 -30.63 6.66 Favored 'General case' 0 N--CA 1.466 0.354 0 C-N-CA 125.135 1.374 . . . . 0.0 113.524 -175.213 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.25 -66.65 0.09 Allowed 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 126.983 2.113 . . . . 0.0 114.221 -174.732 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -65.34 -39.16 92.03 Favored 'General case' 0 N--CA 1.456 -0.139 0 CA-C-O 121.051 0.453 . . . . 0.0 110.222 -171.024 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 53' ' ' ILE . . . . . 0.647 HD12 ' H ' ' B' ' 53' ' ' ILE . 1.6 mp -64.35 -54.23 33.42 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.5 0 N-CA-C 106.853 -1.536 . . . . 0.0 106.853 -176.946 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 75.6 t -58.09 -44.05 86.55 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.459 0 CA-C-O 118.406 -0.807 . . . . 0.0 110.196 178.794 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -54.92 -52.87 61.6 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 119.528 1.058 . . . . 0.0 110.509 174.396 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 37.0 mt -54.21 -46.18 72.39 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-O 119.17 -0.443 . . . . 0.0 111.243 179.496 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 26.5 mmt -66.9 -59.24 3.68 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-O 121.534 0.683 . . . . 0.0 109.868 179.309 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -48.71 -39.73 25.77 Favored 'General case' 0 N--CA 1.455 -0.181 0 C-N-CA 126.58 1.952 . . . . 0.0 111.337 -177.079 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -37.6 -50.22 1.14 Allowed 'General case' 0 N--CA 1.454 -0.268 0 C-N-CA 126.024 1.73 . . . . 0.0 112.507 -174.195 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 3.1 pp -62.97 -35.57 80.61 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 112.554 0.576 . . . . 0.0 112.554 -175.366 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -85.99 -33.2 21.15 Favored 'General case' 0 C--O 1.224 -0.286 0 C-N-CA 123.184 0.593 . . . . 0.0 110.457 178.512 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 6.6 ttp180 -58.86 -56.62 19.84 Favored 'General case' 0 N--CA 1.452 -0.359 0 CA-C-O 122.111 0.957 . . . . 0.0 108.603 175.186 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 63' ' ' ASN . . . . . . . . . . . . . 52.9 m-80 -84.65 57.24 4.24 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 124.238 1.015 . . . . 0.0 109.74 -172.73 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 51.2 mttp -55.84 -37.1 68.28 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 121.274 0.559 . . . . 0.0 110.489 177.554 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -64.08 -11.03 25.95 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.758 1.223 . . . . 0.0 113.081 177.357 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 76.89 -54.72 0.57 Allowed 'General case' 0 C--O 1.233 0.196 0 C-N-CA 126.632 1.973 . . . . 0.0 110.109 -177.707 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 25.9 mt-10 -97.15 156.53 16.35 Favored 'General case' 0 N--CA 1.453 -0.302 0 C-N-CA 123.445 0.698 . . . . 0.0 110.923 170.541 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 6.0 m -136.88 160.0 36.89 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.247 0 C-N-CA 124.122 0.969 . . . . 0.0 109.471 169.236 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 17.4 p30 -85.94 169.2 13.48 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 125.759 1.623 . . . . 0.0 110.886 174.327 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -39.92 -58.75 1.33 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 124.982 1.313 . . . . 0.0 113.664 173.932 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 38.4 tp60 -61.76 -40.97 97.0 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 120.786 -1.196 . . . . 0.0 110.981 -174.239 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -68.02 -33.82 75.32 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 121.78 -0.575 . . . . 0.0 110.862 177.94 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -57.72 -55.09 39.33 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 168.669 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 22.1 mm -52.79 -42.62 42.89 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.212 0 C-N-CA 122.821 0.448 . . . . 0.0 109.95 179.7 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 49.5 m -55.4 -36.29 66.28 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 122.779 0.432 . . . . 0.0 111.376 178.425 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 18.3 t80 -58.46 -53.1 62.09 Favored 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 174.969 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 41.8 mt -60.51 -43.07 97.45 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 123.056 0.542 . . . . 0.0 111.17 178.715 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -65.23 -46.77 86.05 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 110.882 -0.887 . . . . 0.0 110.882 -176.654 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.39 -46.92 88.15 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 117.696 0.748 . . . . 0.0 110.543 175.84 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -51.83 -56.15 15.72 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-O 121.766 0.793 . . . . 0.0 109.983 174.426 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -52.43 -48.98 65.44 Favored 'General case' 0 N--CA 1.451 -0.42 0 C-N-CA 124.113 0.965 . . . . 0.0 110.474 178.457 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 50.3 ttm -58.3 -49.5 76.93 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 123.912 0.885 . . . . 0.0 110.971 179.855 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 84.1 mt -64.6 -43.39 96.72 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 CA-C-O 118.186 -0.912 . . . . 0.0 111.233 -175.596 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.445 1.3 p90 -79.43 -40.34 30.18 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 119.784 1.174 . . . . 0.0 113.607 178.694 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 37.4 m-80 -79.14 70.73 5.56 Favored 'General case' 0 N--CA 1.462 0.136 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 170.567 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -40.89 -41.98 1.73 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.521 1.528 . . . . 0.0 112.6 -174.841 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -33.29 -54.33 0.4 Allowed 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 125.766 1.626 . . . . 0.0 113.044 169.954 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 85.4 mt -66.88 -5.19 11.49 Favored 'General case' 0 C--O 1.225 -0.235 0 C-N-CA 124.146 0.978 . . . . 0.0 113.146 -173.555 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -70.27 -31.82 69.36 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 119.982 1.265 . . . . 0.0 109.741 169.246 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.133 0 CA-C-O 116.932 -2.038 . . . . 0.0 110.912 -177.686 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 92.5 mtp . . . . . 0 N--CA 1.475 0.782 0 N-CA-C 109.805 -0.443 . . . . 0.0 109.805 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -78.18 67.85 4.09 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-O 120.862 0.363 . . . . 0.0 110.238 178.809 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 4.2 m -53.35 160.54 1.74 Allowed Pre-proline 0 CA--C 1.536 0.442 0 C-N-CA 124.278 1.031 . . . . 0.0 111.113 175.09 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_exo -43.15 -49.5 7.13 Favored 'Trans proline' 0 N--CA 1.459 -0.503 0 C-N-CA 123.528 2.819 . . . . 0.0 113.172 176.28 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.431 HD23 ' HA ' ' A' ' 5' ' ' LEU . 7.3 mt -57.25 -48.5 78.68 Favored 'General case' 0 C--O 1.223 -0.33 0 CA-C-O 119.305 -0.379 . . . . 0.0 111.719 174.577 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 18.9 t70 -59.41 -47.18 86.46 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 118.548 0.613 . . . . 0.0 109.666 -177.081 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 16.0 tt0 -56.08 -52.69 63.38 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.355 0.662 . . . . 0.0 110.375 176.209 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -65.52 -45.11 84.75 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 123.383 0.673 . . . . 0.0 112.023 -174.606 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 76.0 mt -55.69 -50.18 69.23 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 171.534 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -47.21 -50.03 17.68 Favored Glycine 0 CA--C 1.528 0.863 0 C-N-CA 124.422 1.011 . . . . 0.0 111.488 173.609 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.1 mt -55.83 -56.76 16.77 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 117.586 0.693 . . . . 0.0 111.282 174.848 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 10.1 mp -58.32 -44.14 88.51 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 119.257 0.935 . . . . 0.0 111.639 -177.659 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 96.3 mt -56.49 -54.91 22.77 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.2 0 C-N-CA 123.413 0.685 . . . . 0.0 110.198 173.181 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.64 -50.15 58.62 Favored Glycine 0 CA--C 1.523 0.567 0 N-CA-C 110.364 -1.094 . . . . 0.0 110.364 -177.351 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 9.5 mm -54.27 -47.62 68.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 C-N-CA 123.229 0.611 . . . . 0.0 110.107 175.915 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 50.6 t80 -56.1 -59.35 5.05 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-N 118.401 0.546 . . . . 0.0 109.998 176.506 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 2.7 t-80 -56.62 -35.47 68.34 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.734 1.214 . . . . 0.0 111.514 -173.732 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -48.88 -36.33 16.81 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 123.943 0.897 . . . . 0.0 111.779 177.143 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 54.6 m-85 -106.81 -55.73 2.29 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.34 0.656 . . . . 0.0 109.393 178.461 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.9 -32.08 60.7 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 124.103 0.961 . . . . 0.0 111.645 -176.38 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -47.17 -34.23 8.01 Favored Glycine 0 CA--C 1.526 0.769 0 CA-C-O 118.745 -1.031 . . . . 0.0 114.192 179.803 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.93 -1.8 48.47 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 118.48 1.14 . . . . 0.0 113.691 -178.168 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -79.49 132.43 36.33 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 106.011 -1.848 . . . . 0.0 106.011 169.637 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . -48.3 -58.08 7.56 Favored Glycine 0 CA--C 1.528 0.898 0 N-CA-C 111.4 -0.68 . . . . 0.0 111.4 -174.657 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -79.96 86.27 5.48 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 106.719 -1.585 . . . . 0.0 106.719 168.758 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 31.6 mtmm -58.58 -15.2 10.4 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 124.745 1.218 . . . . 0.0 113.501 -174.127 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 16.6 t-160 -75.64 -15.7 60.3 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.117 1.367 . . . . 0.0 110.465 176.135 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 3.3 p -121.27 149.56 42.7 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 125.196 1.399 . . . . 0.0 111.27 179.286 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -144.46 163.56 33.45 Favored 'General case' 0 N--CA 1.455 -0.222 0 C-N-CA 122.573 0.349 . . . . 0.0 111.526 169.709 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 9.7 m -89.36 159.89 17.12 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.095 0.958 . . . . 0.0 113.438 -170.667 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 51.6 pttt -45.99 -42.84 13.64 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 125.272 1.429 . . . . 0.0 112.184 171.793 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 23.2 ttmm -51.97 -50.47 61.2 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 123.483 0.713 . . . . 0.0 110.302 172.815 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 45.3 mm-40 -65.83 -39.99 91.35 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 118.776 -0.631 . . . . 0.0 110.324 -176.897 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 76.0 mt -58.82 -54.97 41.13 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 118.77 0.713 . . . . 0.0 111.161 173.462 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' LYS . . . . . . . . . . . . . 61.8 mttm -56.56 -44.27 80.8 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 123.236 0.614 . . . . 0.0 110.187 -178.422 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -56.81 -67.93 0.27 Allowed 'General case' 0 C--O 1.219 -0.507 0 CA-C-O 118.423 -0.799 . . . . 0.0 109.473 170.555 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.7 mt -34.07 -62.98 0.3 Allowed 'General case' 0 N--CA 1.463 0.209 0 C-N-CA 125.594 1.558 . . . . 0.0 112.132 -178.542 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 18.1 tt -61.26 -48.0 90.92 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.306 0 C-N-CA 120.899 -0.321 . . . . 0.0 110.265 -174.356 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 -62.91 -45.55 91.98 Favored 'General case' 0 CA--C 1.537 0.446 0 O-C-N 121.783 -0.573 . . . . 0.0 111.712 -178.065 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.2 mmpt? -65.07 -58.68 5.44 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 125.397 1.479 . . . . 0.0 109.059 -176.727 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -77.78 -62.36 1.69 Allowed 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.311 -173.226 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 32.8 mt -85.2 61.99 7.22 Favored 'General case' 0 N--CA 1.45 -0.427 0 CA-C-O 121.394 0.616 . . . . 0.0 109.557 -174.956 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 1.4 t -75.41 60.37 1.15 Allowed 'General case' 0 CA--C 1.538 0.508 0 N-CA-C 106.278 -1.749 . . . . 0.0 106.278 166.945 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.417 ' O ' HG23 ' A' ' 44' ' ' ILE . 4.8 tt -76.52 81.95 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.57 0 C-N-CA 124.011 0.924 . . . . 0.0 110.401 -166.963 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 49.05 50.77 26.93 Favored Glycine 0 CA--C 1.524 0.636 0 C-N-CA 125.339 1.447 . . . . 0.0 112.269 169.932 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.6 m 56.72 44.73 23.11 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.595 0.758 . . . . 0.0 112.052 -176.346 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 62.5 mttm 71.9 62.81 0.14 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.451 1.5 . . . . 0.0 110.875 171.353 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 46.9 mt -35.88 -52.77 0.74 Allowed 'General case' 0 N--CA 1.467 0.397 0 N-CA-C 114.59 1.33 . . . . 0.0 114.59 -177.358 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 65.1 tt0 -150.27 146.91 27.07 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 121.009 0.433 . . . . 0.0 110.703 -170.382 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -25.8 -46.61 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 130.469 3.508 . . . . 0.0 115.207 -176.863 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -31.99 -58.15 0.3 Allowed 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 125.49 1.516 . . . . 0.0 113.35 176.866 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 19.3 tt0 -65.92 -38.42 88.64 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-O 121.268 0.556 . . . . 0.0 111.197 -175.289 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.503 ' CD1' ' H ' ' A' ' 53' ' ' ILE . 1.0 OUTLIER -66.06 -50.13 71.55 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.648 0 N-CA-C 106.864 -1.532 . . . . 0.0 106.864 -176.157 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 71.6 t -55.49 -54.31 26.87 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 CA-C-O 118.475 -0.774 . . . . 0.0 109.364 174.682 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -47.98 -54.45 12.82 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.629 0.65 . . . . 0.0 110.847 179.332 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 12.8 mt -51.94 -43.35 63.42 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 122.879 0.472 . . . . 0.0 112.197 -177.249 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -78.69 -59.38 2.8 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 122.926 0.49 . . . . 0.0 110.335 -179.661 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -39.71 -37.2 0.49 Allowed 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 126.785 2.034 . . . . 0.0 111.872 176.575 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 11.6 t0 -36.75 -57.3 0.8 Allowed 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 125.239 1.416 . . . . 0.0 111.408 172.871 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 2.5 pp -65.42 -30.75 71.59 Favored 'General case' 0 CA--C 1.532 0.276 0 O-C-N 121.856 -0.527 . . . . 0.0 111.658 -174.346 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -82.1 -36.67 27.33 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 123.43 0.692 . . . . 0.0 110.523 -175.036 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 13.1 ptt180 -75.06 -44.95 44.68 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 118.813 0.733 . . . . 0.0 109.422 173.714 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -76.45 51.2 0.7 Allowed 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 124.119 0.968 . . . . 0.0 110.535 178.679 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 53.2 mttp -58.45 -44.07 89.05 Favored 'General case' 0 CA--C 1.532 0.272 0 O-C-N 121.38 -0.825 . . . . 0.0 108.968 177.132 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -84.35 23.2 1.13 Allowed 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 124.158 0.983 . . . . 0.0 111.609 175.874 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 71.8 -49.7 0.69 Allowed 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 126.298 1.839 . . . . 0.0 114.183 174.019 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -99.89 159.89 14.73 Favored 'General case' 0 CA--C 1.528 0.13 0 N-CA-C 113.43 0.9 . . . . 0.0 113.43 -177.182 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 12.7 m -134.37 159.43 42.01 Favored 'Isoleucine or valine' 0 C--O 1.232 0.159 0 C-N-CA 126.224 1.81 . . . . 0.0 107.805 169.406 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -91.44 174.26 7.47 Favored 'General case' 0 C--N 1.34 0.165 0 C-N-CA 123.612 0.765 . . . . 0.0 111.59 175.798 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 49.3 t80 -42.31 -63.46 0.75 Allowed 'General case' 0 CA--C 1.533 0.316 0 C-N-CA 124.376 1.07 . . . . 0.0 112.84 173.839 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -61.64 -35.25 77.38 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 120.329 1.422 . . . . 0.0 111.694 -176.179 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -63.6 -41.4 98.32 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 119.836 1.198 . . . . 0.0 111.315 174.33 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -55.04 -51.63 65.69 Favored 'General case' 0 CA--C 1.535 0.389 0 O-C-N 121.01 -1.056 . . . . 0.0 109.608 169.853 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 74' ' ' ILE . . . . . . . . . . . . . 23.8 mm -55.97 -36.13 43.32 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 C-N-CA 122.804 0.442 . . . . 0.0 110.245 176.395 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 56.8 m -67.2 -34.48 77.6 Favored 'General case' 0 C--O 1.225 -0.223 0 O-C-N 121.302 -0.874 . . . . 0.0 110.635 177.06 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 4.7 t80 -53.91 -54.48 38.2 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 169.813 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 59.6 mt -64.2 -41.36 97.11 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 123.306 0.642 . . . . 0.0 112.034 -178.254 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . -70.16 -44.46 60.27 Favored Glycine 0 CA--C 1.525 0.697 0 N-CA-C 110.416 -1.073 . . . . 0.0 110.416 -176.689 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 79' ' ' ALA . . . . . . . . . . . . . . . -61.08 -49.58 76.74 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 122.171 -0.605 . . . . 0.0 109.754 174.393 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 11.1 tp -48.45 -59.27 3.61 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 121.464 0.65 . . . . 0.0 109.988 173.922 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -49.64 -53.02 26.59 Favored 'General case' 0 N--CA 1.448 -0.541 0 C-N-CA 124.804 1.242 . . . . 0.0 110.581 179.773 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 82' ' ' MET . . . . . . . . . . . . . 14.2 ttp -67.1 -36.61 82.31 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 123.357 0.663 . . . . 0.0 111.92 -175.166 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 96.7 mt -63.93 -59.39 4.35 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 CA-C-N 118.791 0.723 . . . . 0.0 109.52 175.679 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . 0.417 0.3 OUTLIER -70.91 -38.33 72.95 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 118.512 -1.275 . . . . 0.0 112.424 -174.21 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 35.1 m-80 -81.78 67.68 7.85 Favored 'General case' 0 N--CA 1.465 0.287 0 O-C-N 120.545 -1.347 . . . . 0.0 107.639 168.994 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -41.24 -40.13 1.53 Allowed 'General case' 0 N--CA 1.462 0.155 0 C-N-CA 125.767 1.627 . . . . 0.0 112.293 -175.242 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -34.55 -53.28 0.52 Allowed 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 125.352 1.461 . . . . 0.0 113.037 172.401 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 90.9 mt -61.0 -15.52 32.71 Favored 'General case' 0 C--O 1.225 -0.23 0 N-CA-C 113.156 0.798 . . . . 0.0 113.156 -174.226 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 97.2 mttt -66.18 -28.82 69.06 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.751 1.159 . . . . 0.0 111.404 175.079 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.345 0 CA-C-O 117.225 -1.875 . . . . 0.0 111.857 -174.234 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 3.2 mpp? . . . . . 0 N--CA 1.471 0.583 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -76.21 69.89 2.79 Favored 'General case' 0 CA--C 1.531 0.227 0 N-CA-C 109.897 -0.408 . . . . 0.0 109.897 177.195 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 11.9 m -53.8 159.7 2.51 Favored Pre-proline 0 CA--C 1.537 0.479 0 C-N-CA 123.741 0.816 . . . . 0.0 111.147 176.512 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 4' ' ' PRO . . . . . . . . . . . . . 62.7 Cg_exo -42.11 -48.83 6.19 Favored 'Trans proline' 0 N--CA 1.458 -0.605 0 C-N-CA 123.868 3.045 . . . . 0.0 113.507 177.645 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 5' ' ' LEU . . . . . . . . . . . . . 6.3 mt -54.25 -51.11 65.55 Favored 'General case' 0 C--O 1.224 -0.238 0 CA-C-O 119.564 -0.255 . . . . 0.0 111.521 174.051 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 6' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -62.99 -40.46 97.8 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 118.254 0.479 . . . . 0.0 110.144 -175.674 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 7' ' ' GLN . . . . . . . . . . . . . 13.7 tp60 -63.9 -46.35 85.24 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 122.512 -0.118 . . . . 0.0 110.96 176.391 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 8' ' ' ALA . . . . . . . . . . . . . . . -63.31 -46.01 88.71 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.593 0.757 . . . . 0.0 110.819 -179.313 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 9' ' ' ILE . . . . . . . . . . . . . 63.0 mt -52.84 -53.23 22.27 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.254 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 169.678 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 10' ' ' GLY . . . . . . . . . . . . . . . -46.77 -46.66 18.86 Favored Glycine 0 CA--C 1.528 0.854 0 C-N-CA 125.164 1.364 . . . . 0.0 112.05 175.422 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 mt -58.09 -54.19 49.81 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 117.71 0.755 . . . . 0.0 111.166 174.534 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 12' ' ' LEU . . . . . . . . . . . . . 9.9 mp -57.91 -42.78 85.49 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 118.791 0.723 . . . . 0.0 111.407 179.323 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 85.9 mt -56.4 -56.13 15.27 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.401 0 C-N-CA 123.629 0.772 . . . . 0.0 109.669 173.316 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . -54.2 -48.8 62.23 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.749 -0.94 . . . . 0.0 110.749 -177.754 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 15' ' ' ILE . . . . . . . . . . . . . 9.1 mm -56.44 -47.23 81.93 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 175.978 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -55.99 -60.81 2.94 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 118.626 0.648 . . . . 0.0 109.923 176.484 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 17' ' ' HIS . . . . . . . . . . . . . 2.9 t-80 -43.32 -50.1 6.73 Favored 'General case' 0 N--CA 1.455 -0.221 0 C-N-CA 128.168 2.587 . . . . 0.0 110.467 -177.992 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 65.4 tttp -48.38 -36.84 15.41 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.583 1.153 . . . . 0.0 112.355 178.266 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 -119.48 36.12 4.6 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.124 0.97 . . . . 0.0 111.236 179.875 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 20' ' ' SER . . . . . . . . . . . . . 19.9 p -159.83 -64.47 0.07 Allowed 'General case' 0 N--CA 1.466 0.372 0 O-C-N 121.309 -0.869 . . . . 0.0 109.793 172.505 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 21' ' ' GLY . . . . . . . . . . . . . . . -61.24 72.02 0.01 OUTLIER Glycine 0 CA--C 1.522 0.514 0 C-N-CA 127.051 2.263 . . . . 0.0 111.87 177.248 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 11.2 ptmm? -165.83 -122.55 0.01 OUTLIER 'General case' 0 N--CA 1.446 -0.654 0 C-N-CA 125.36 1.464 . . . . 0.0 107.332 176.13 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 23' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -76.06 62.58 1.69 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.436 1.095 . . . . 0.0 110.666 -177.075 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 24' ' ' GLY . . . . . . . . . . . . . . . 177.71 -177.3 48.33 Favored Glycine 0 CA--C 1.525 0.676 0 O-C-N 121.74 -0.6 . . . . 0.0 112.151 179.679 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 25' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -77.91 79.95 4.37 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 108.078 -1.082 . . . . 0.0 108.078 -178.523 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 26' ' ' LYS . . . . . . . . . . . . . 34.6 mttp -29.77 -30.55 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 130.768 3.627 . . . . 0.0 117.849 -171.67 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 20.1 t-160 -76.17 -13.35 60.19 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 124.546 1.138 . . . . 0.0 111.358 179.275 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 28' ' ' THR . . . . . . . . . . . . . 73.4 p -128.33 164.81 21.83 Favored 'General case' 0 N--CA 1.455 -0.206 0 C-N-CA 124.819 1.248 . . . . 0.0 112.393 -173.136 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . . . . . . . . . 3.4 pp -156.49 178.18 10.61 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.88 1.672 . . . . 0.0 107.225 169.78 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 30' ' ' SER . . . . . . . . . . . . . 61.8 p -123.46 177.03 5.82 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 119.326 0.966 . . . . 0.0 112.43 -177.369 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 7.0 ptpp? -40.3 -46.88 2.4 Favored 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 125.475 1.51 . . . . 0.0 112.945 175.659 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 32' ' ' LYS . . . . . . . . . . . . . 1.2 tmmt? -62.59 -42.64 99.68 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 -176.3 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 5.7 mp0 -67.58 -41.44 84.12 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 118.596 -0.716 . . . . 0.0 110.301 178.182 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 34' ' ' LEU . . . . . 0.499 HD12 HD21 ' B' ' 63' ' ' ASN . 13.7 mt -58.98 -48.89 79.95 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 119.424 1.011 . . . . 0.0 111.107 175.23 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 35' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -57.22 -50.52 72.62 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 178.341 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 64.2 mt-10 -50.8 -62.25 1.72 Allowed 'General case' 0 C--O 1.223 -0.334 0 CA-C-O 119.432 -0.318 . . . . 0.0 110.359 173.619 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 37' ' ' LEU . . . . . . . . . . . . . 12.3 mt -43.1 -64.86 0.56 Allowed 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.86 1.264 . . . . 0.0 110.841 179.573 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 38' ' ' ILE . . . . . . . . . . . . . 13.8 tt -61.66 -47.73 91.99 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 C-N-CA 120.452 -0.499 . . . . 0.0 110.382 -171.456 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 20.0 tt0 -67.37 -49.38 64.19 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 118.271 0.487 . . . . 0.0 111.819 -176.009 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.15 -55.38 16.65 Favored 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 109.019 -0.734 . . . . 0.0 109.019 -178.054 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 41' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -73.03 -51.21 19.05 Favored 'General case' 0 N--CA 1.451 -0.401 0 O-C-N 122.354 -0.216 . . . . 0.0 110.43 -172.211 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 96.0 mt -102.41 63.53 0.88 Allowed 'General case' 0 C--O 1.226 -0.139 0 CA-C-O 121.205 0.526 . . . . 0.0 111.099 -174.043 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 12.0 p -60.97 -39.61 90.24 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 165.569 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 44' ' ' ILE . . . . . . . . . . . . 0.26 11.0 tt 51.19 52.57 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.262 0 C-N-CA 127.593 2.357 . . . . 0.0 110.046 169.616 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 45' ' ' GLY . . . . . . . . . . . . . . . 72.16 -74.96 0.81 Allowed Glycine 0 CA--C 1.525 0.666 0 N-CA-C 109.05 -1.62 . . . . 0.0 109.05 -172.422 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 17.7 m -166.46 74.07 0.16 Allowed 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 125.345 1.458 . . . . 0.0 109.354 176.41 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 47' ' ' LYS . . . . . 0.443 ' HB3' HD11 ' B' ' 53' ' ' ILE . 68.8 mttm 51.68 66.4 1.21 Allowed 'General case' 0 CA--C 1.538 0.506 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 168.887 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 48' ' ' LEU . . . . . . . . . . . . . 18.0 mt -65.6 96.56 0.27 Allowed 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.928 -0.482 . . . . 0.0 111.034 -177.338 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 1.7 tm0? 79.59 152.75 0.12 Allowed 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 125.921 1.688 . . . . 0.0 110.92 171.376 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 50' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -39.84 -38.36 0.66 Allowed 'General case' 0 N--CA 1.463 0.214 0 C-N-CA 126.649 1.98 . . . . 0.0 114.66 -170.726 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 51' ' ' ALA . . . . . . . . . . . . . . . -29.68 -60.63 0.15 Allowed 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.999 1.72 . . . . 0.0 114.264 -179.198 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 52' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 -65.59 -38.69 90.23 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 121.306 0.574 . . . . 0.0 111.307 -174.058 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 53' ' ' ILE . . . . . 0.624 HD12 ' H ' ' B' ' 53' ' ' ILE . 2.4 mp -67.69 -52.97 34.98 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.548 0 N-CA-C 106.597 -1.631 . . . . 0.0 106.597 -176.443 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 55.4 t -49.18 -48.92 17.41 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 C-N-CA 125.003 1.321 . . . . 0.0 109.645 173.467 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 55' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -57.67 -50.02 74.56 Favored 'General case' 0 N--CA 1.457 -0.111 0 CA-C-N 118.577 0.626 . . . . 0.0 111.119 177.708 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 23.9 mt -54.74 -36.6 64.96 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-O 119.111 -0.471 . . . . 0.0 111.487 177.381 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 57' ' ' MET . . . . . . . . . . . . . 28.1 mmt -70.1 -59.52 2.85 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 118.963 0.801 . . . . 0.0 109.838 174.676 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 58' ' ' ASP . . . . . . . . . . . . . 81.0 m-20 -45.55 -37.39 5.4 Favored 'General case' 0 N--CA 1.464 0.264 0 C-N-CA 126.549 1.94 . . . . 0.0 111.27 -178.483 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 59' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -38.08 -51.9 1.41 Allowed 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 126.039 1.736 . . . . 0.0 111.029 176.398 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -59.77 -47.42 85.74 Favored 'General case' 0 N--CA 1.456 -0.149 0 C-N-CA 122.702 0.401 . . . . 0.0 110.35 -177.864 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -63.1 -53.96 45.41 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 122.703 0.401 . . . . 0.0 110.072 -179.418 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 62' ' ' ARG . . . . . . . . . . . . . 61.4 mtp180 -54.98 -41.86 71.73 Favored 'General case' 0 N--CA 1.456 -0.157 0 O-C-N 121.955 -0.466 . . . . 0.0 110.301 179.897 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 63' ' ' ASN . . . . . 0.499 HD21 HD12 ' B' ' 34' ' ' LEU . 15.4 m-80 -87.35 30.62 0.78 Allowed 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 179.098 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 64' ' ' LYS . . . . . . . . . . . . . 40.5 mtpt -57.54 -39.13 75.94 Favored 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 166.278 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 65' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -73.63 6.76 2.86 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.555 1.142 . . . . 0.0 112.803 173.398 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 66' ' ' GLN . . . . . . . . . . . . . 81.0 mm-40 70.91 -55.24 0.65 Allowed 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 127.013 2.125 . . . . 0.0 113.152 179.34 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 4.5 mp0 -101.65 156.29 17.58 Favored 'General case' 0 N--CA 1.453 -0.277 0 C-N-CA 124.534 1.134 . . . . 0.0 110.74 178.325 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 10.1 m -130.92 158.63 43.26 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 C-N-CA 126.686 1.995 . . . . 0.0 106.666 168.849 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -99.81 175.2 5.87 Favored 'General case' 0 N--CA 1.462 0.13 0 C-N-CA 124.053 0.941 . . . . 0.0 111.13 177.688 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 52.7 t80 -40.96 -63.83 0.62 Allowed 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.239 1.015 . . . . 0.0 112.61 172.38 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 71' ' ' GLN . . . . . . . . . . . . . 50.9 tp60 -61.52 -36.34 80.28 Favored 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 119.59 1.087 . . . . 0.0 111.711 -174.842 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -62.7 -43.01 99.9 Favored 'General case' 0 CA--C 1.538 0.481 0 O-C-N 121.374 -0.829 . . . . 0.0 110.775 175.62 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -56.29 -51.29 68.71 Favored 'General case' 0 CA--C 1.535 0.403 0 O-C-N 121.838 -0.539 . . . . 0.0 109.884 170.975 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 74' ' ' ILE . . . . . . . . . . . . . 27.5 mm -55.58 -37.57 46.4 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 O-C-N 121.959 -0.463 . . . . 0.0 110.289 177.554 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 75' ' ' THR . . . . . . . . . . . . . 47.8 m -64.76 -37.11 86.51 Favored 'General case' 0 CA--C 1.529 0.139 0 O-C-N 121.682 -0.636 . . . . 0.0 110.603 175.95 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 76' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -55.82 -52.98 62.14 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 108.99 -0.745 . . . . 0.0 108.99 173.663 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 54.6 mt -62.29 -44.69 95.94 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.55 179.377 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 78' ' ' GLY . . . . . . . . . . . . . . . -60.99 -47.91 88.9 Favored Glycine 0 CA--C 1.526 0.728 0 N-CA-C 110.681 -0.968 . . . . 0.0 110.681 -178.901 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 79' ' ' ALA . . . . . . . . . . . . . . . -65.16 -41.22 94.9 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 122.147 -0.619 . . . . 0.0 110.407 177.433 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 23.0 tp -54.04 -56.82 14.36 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 118.636 0.653 . . . . 0.0 109.688 174.611 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 81' ' ' ALA . . . . . . . . . . . . . . . -48.58 -50.92 30.36 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 124.524 1.129 . . . . 0.0 109.989 175.891 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 82' ' ' MET . . . . . . . . . . . . . 44.7 ttm -58.15 -49.11 78.12 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.209 0.604 . . . . 0.0 111.669 -179.078 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 83' ' ' ILE . . . . . . . . . . . . . 81.1 mt -65.27 -51.12 68.87 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.67 -176.033 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 84' ' ' TYR . . . . . . . . . . . . 0.45 0.1 OUTLIER -76.34 -38.64 55.63 Favored 'General case' 0 C--N 1.345 0.392 0 CA-C-N 119.678 1.127 . . . . 0.0 112.958 -177.153 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' B' B ' 85' ' ' ASN . . . . . . . . . . . . . 23.2 m-80 -82.93 68.57 9.47 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 169.33 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 87.8 mt-10 -41.56 -38.57 1.37 Allowed 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 125.749 1.619 . . . . 0.0 112.688 -173.309 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -35.44 -53.97 0.66 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.046 1.338 . . . . 0.0 112.768 171.583 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 88' ' ' LEU . . . . . . . . . . . . . 92.3 mt -64.98 -7.1 10.27 Favored 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 124.037 0.935 . . . . 0.0 113.347 -174.46 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -67.29 -32.95 74.29 Favored 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 120.059 1.3 . . . . 0.0 110.484 170.45 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.083 0 CA-C-O 117.69 -1.617 . . . . 0.0 111.995 -172.838 . . . . . . . . 0 0 . 1 stop_ save_