data_2lr8_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 2lr8 _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 ' 17' ' ' TRP . . . . . . . . . . . . . 90.9 m95 . . . . . 0 N--CA 1.487 1.421 0 N-CA-C 110.389 -0.226 . . . . 74.31 110.389 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 44.8 p -126.16 169.44 12.83 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.117 0.567 . . . . 65.02 111.201 179.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -51.9 -33.11 35.45 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 124.831 1.252 . . . . 75.02 114.063 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -73.52 -34.73 65.38 Favored 'General case' 0 CA--C 1.558 1.267 0 C-N-CA 123.094 0.558 . . . . 71.44 111.244 -176.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -69.71 -52.38 26.07 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.307 0.643 . . . . 73.01 112.013 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -58.83 -31.63 68.65 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.852 0.861 . . . . 72.34 112.549 -178.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 74.4 ttt180 -62.59 -46.2 89.41 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 122.29 0.236 . . . . 75.32 111.068 174.145 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 36.8 t -63.37 -39.15 84.21 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 C-N-CA 123.253 0.621 . . . . 74.4 111.092 -179.087 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.411 ' HA ' HD12 ' A' ' 42' ' ' LEU . 87.0 mt -54.81 -57.79 5.79 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.238 0 C-N-CA 123.225 0.61 . . . . 75.34 110.95 175.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.41 ' HG ' HD12 ' A' ' 60' ' ' LEU . 94.2 mt -63.05 -34.07 76.79 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.399 0.68 . . . . 72.45 112.142 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 31.7 tp -65.01 -53.39 46.9 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.428 0.691 . . . . 75.43 111.626 -177.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 48.1 mm-40 -75.76 -24.63 56.08 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 122.846 0.458 . . . . 74.12 112.2 179.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 41.5 t -68.94 -38.5 79.51 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 122.677 0.391 . . . . 64.41 111.364 177.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -80.75 -35.18 33.67 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.232 0.613 . . . . 73.35 111.203 177.184 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -64.28 -47.15 80.64 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 123.531 0.732 . . . . 71.41 111.852 177.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 36.8 mtt180 -104.6 -68.21 0.86 Allowed 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.649 0.78 . . . . 72.34 110.719 -173.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 145.81 135.51 2.81 Favored Glycine 0 CA--C 1.534 1.227 0 CA-C-O 118.885 -0.953 . . . . 74.33 110.912 -172.024 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -66.76 87.75 0.29 Allowed 'Trans proline' 0 CA--C 1.561 1.872 0 C-N-CA 122.716 2.278 . . . . 72.23 113.342 -178.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 98.7 p -126.55 163.45 23.38 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.128 0.971 . . . . 71.52 110.149 178.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 68.8 p -55.15 -39.82 69.9 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 123.953 0.901 . . . . 71.23 113.027 -179.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 63.7 pttt -73.76 -25.98 60.42 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.496 0.718 . . . . 73.52 112.335 179.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 86.4 m -76.1 -39.56 54.98 Favored 'General case' 0 N--CA 1.484 1.24 0 N-CA-C 108.87 -0.789 . . . . 73.24 108.87 175.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -67.16 -28.83 68.45 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 115.322 -0.854 . . . . 75.1 111.254 173.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.404 ' HA ' ' HG3' ' A' ' 50' ' ' PRO . . . -73.09 -35.95 66.71 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.749 0.82 . . . . 65.32 111.863 175.097 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -62.71 -50.37 71.39 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.184 0.594 . . . . 74.22 110.406 171.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.411 HD12 ' HA ' ' A' ' 25' ' ' ILE . 76.3 mt -66.21 -25.64 67.02 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.555 1.142 . . . . 74.34 112.192 177.229 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.39 -58.48 5.2 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.315 0.646 . . . . 64.03 111.117 175.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.84 -36.15 76.23 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 123.5 0.72 . . . . 51.41 111.945 178.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.25 -49.75 70.67 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 124.175 0.99 . . . . 74.55 111.81 176.217 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 52.3 mt -99.5 14.6 29.32 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 113.196 0.813 . . . . 74.34 113.196 -170.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 68.25 13.96 9.14 Favored 'General case' 0 N--CA 1.508 2.434 0 C-N-CA 125.071 1.349 . . . . 74.01 113.211 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -103.48 -176.72 3.16 Favored 'General case' 0 N--CA 1.483 1.182 0 CA-C-O 121.768 0.794 . . . . 75.22 112.843 -173.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -102.76 153.91 37.88 Favored Pre-proline 0 CA--C 1.559 1.296 0 CA-C-N 115.003 -0.999 . . . . 65.03 109.421 166.484 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.404 ' HG3' ' HA ' ' A' ' 40' ' ' ALA . 92.0 Cg_exo -47.11 -35.12 18.7 Favored 'Trans proline' 0 C--N 1.388 2.645 0 C-N-CA 123.623 2.882 . . . . 75.21 114.631 177.174 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.419 ' O ' ' HG3' ' A' ' 55' ' ' GLU . 78.8 m-20 -59.63 -50.55 73.42 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.613 0.765 . . . . 75.5 111.585 176.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 83.1 mm-40 -55.83 -46.43 78.13 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 123.56 0.744 . . . . 75.41 112.111 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.405 HG12 ' HB2' ' A' ' 42' ' ' LEU . 76.8 t -64.74 -45.78 94.14 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 CA-C-N 115.163 -0.926 . . . . 71.53 111.631 -178.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.3 t -59.47 -44.13 93.08 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.303 0.641 . . . . 62.54 111.941 179.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.419 ' HG3' ' O ' ' A' ' 51' ' ' ASN . 60.0 mt-10 -57.78 -50.82 71.97 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.127 0.571 . . . . 74.0 111.435 177.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 40.3 mmt-85 -68.78 -35.2 76.75 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 122.677 0.391 . . . . 75.13 111.908 -176.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -52.77 -52.77 55.25 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.422 0.689 . . . . 71.35 110.964 170.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -69.61 -25.14 63.81 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 115.337 -0.847 . . . . 64.54 112.133 -176.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.409 ' HG2' ' O ' ' A' ' 55' ' ' GLU . 30.9 mm-40 -68.56 -54.42 16.74 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 109.373 -0.602 . . . . 72.4 109.373 172.406 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.41 HD12 ' HG ' ' A' ' 26' ' ' LEU . 21.0 mt -47.61 -48.02 28.53 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 125.02 1.328 . . . . 63.41 112.607 179.015 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' MET . . . . . 0.452 ' HA ' ' HE1' ' A' ' 61' ' ' MET . 23.7 mmt . . . . . 0 N--CA 1.487 1.423 0 C-N-CA 123.297 0.639 . . . . 72.43 111.667 178.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 97.3 m95 . . . . . 0 N--CA 1.484 1.254 0 N-CA-C 110.195 -0.298 . . . . 75.44 110.195 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 30.7 p -135.38 168.57 18.97 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 124.137 0.975 . . . . 60.11 110.448 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 14.5 ptm180 -57.9 -28.33 64.12 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 113.976 1.102 . . . . 73.51 113.976 -171.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -68.82 -34.53 75.66 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.263 0.625 . . . . 71.43 111.463 178.002 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.429 ' HA ' HD22 ' A' ' 46' ' ' LEU . 47.8 m-20 -66.48 -57.7 6.79 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.003 0.521 . . . . 74.45 110.718 175.218 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -54.26 -39.01 66.46 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.506 1.122 . . . . 73.11 112.781 -179.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 61.3 ttt-85 -60.1 -50.33 74.13 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.191 0.597 . . . . 75.34 111.938 178.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 38.4 t -75.0 -31.71 25.63 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 122.708 0.403 . . . . 73.21 111.048 -174.154 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 75.1 mt -60.84 -48.57 88.32 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 C-N-CA 122.146 0.178 . . . . 75.41 110.621 172.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 96.3 mt -66.62 -34.8 78.67 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 123.186 0.594 . . . . 73.15 112.317 177.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 64.2 tp -61.87 -48.08 82.13 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.66 0.784 . . . . 74.2 111.298 177.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.545 ' HB3' HG23 ' A' ' 38' ' ' THR . 26.4 mm-40 -72.56 -32.42 66.04 Favored 'General case' 0 CA--C 1.551 0.988 0 CA-C-N 114.767 -1.106 . . . . 75.33 112.088 176.284 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . 0.444 ' SG ' ' HE1' ' A' ' 57' ' ' PHE . 13.9 t -65.45 -35.46 80.98 Favored 'General case' 0 N--CA 1.491 1.598 0 C-N-CA 123.714 0.805 . . . . 73.32 112.212 179.478 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -90.39 -3.95 57.37 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.057 0.543 . . . . 72.43 111.963 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 27.0 tptp -113.15 -73.3 0.67 Allowed 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 123.123 0.569 . . . . 71.23 110.74 178.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 61.5 mtt180 -81.21 -10.61 59.58 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.257 0.623 . . . . 72.04 112.435 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 82.21 -165.22 44.8 Favored Glycine 0 CA--C 1.538 1.529 0 N-CA-C 114.611 0.604 . . . . 72.11 114.611 173.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -82.39 35.78 0.59 Allowed 'Trans proline' 0 C--N 1.374 1.906 0 C-N-CA 123.54 2.827 . . . . 64.22 113.557 176.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 65.4 m -76.34 152.66 36.29 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.166 0.586 . . . . 65.15 112.182 -177.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 87.5 p -63.7 -30.09 71.23 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 123.252 0.621 . . . . 73.4 110.462 168.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -55.37 -40.04 70.83 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 124.417 1.087 . . . . 73.13 110.977 170.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.545 HG23 ' HB3' ' A' ' 28' ' ' GLU . 32.2 m -75.76 -47.32 26.41 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 114.827 -1.079 . . . . 73.25 109.414 -174.248 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 21.1 m-85 -63.71 -30.43 71.53 Favored 'General case' 0 CA--C 1.551 0.997 0 CA-C-N 114.802 -1.09 . . . . 75.31 112.042 178.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.79 -42.57 77.16 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.421 0.688 . . . . 71.24 111.341 175.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -61.28 -55.75 28.38 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 122.791 0.436 . . . . 72.33 110.522 174.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 72.8 mt -61.47 -25.65 67.38 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.486 1.115 . . . . 75.44 113.107 -178.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.47 -56.13 18.6 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-O 121.153 0.502 . . . . 74.34 111.231 173.085 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -71.66 -30.63 65.94 Favored 'General case' 0 N--CA 1.482 1.174 0 CA-C-N 116.014 -0.539 . . . . 62.41 112.213 -178.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 8.5 tmtm? -73.91 -53.78 9.4 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.988 0.915 . . . . 75.12 110.659 -176.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.429 HD22 ' HA ' ' A' ' 21' ' ' ASP . 88.3 mt -86.73 3.06 46.48 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.262 0.625 . . . . 74.13 112.67 -175.667 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.0 t70 60.5 34.21 20.44 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-O 122.372 1.082 . . . . 63.45 110.666 -175.336 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 47.5 mmtm -107.17 -177.86 3.48 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 115.0 -1.0 . . . . 74.02 111.291 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.465 ' N ' HD21 ' A' ' 49' ' ' ASN . 0.7 OUTLIER -105.37 148.28 36.03 Favored Pre-proline 0 CA--C 1.554 1.131 0 N-CA-C 108.84 -0.8 . . . . 73.13 108.84 172.445 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_exo -53.4 -34.95 73.53 Favored 'Trans proline' 0 C--N 1.384 2.441 0 C-N-CA 122.746 2.297 . . . . 75.31 114.329 178.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 23.8 m120 -68.06 -44.72 75.69 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.654 0.382 . . . . 72.22 111.267 174.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.462 ' HG3' ' HB2' ' A' ' 49' ' ' ASN . 96.5 mt-30 -57.75 -45.4 85.93 Favored 'General case' 0 N--CA 1.494 1.73 0 C-N-CA 123.037 0.535 . . . . 71.13 111.393 176.25 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 87.9 t -63.83 -50.88 75.7 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.896 0 C-N-CA 123.717 0.807 . . . . 73.54 111.628 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.447 ' O ' ' HG3' ' A' ' 58' ' ' GLN . 90.2 p -60.78 -43.41 98.13 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.185 0.594 . . . . 74.14 112.21 -176.313 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.425 ' O ' ' HG2' ' A' ' 59' ' ' GLN . 44.0 mt-10 -67.05 -43.66 82.16 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.148 0.579 . . . . 74.01 111.871 178.427 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 22.1 tpt180 -62.9 -39.95 96.1 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 123.137 0.575 . . . . 74.23 111.396 177.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.444 ' HE1' ' SG ' ' A' ' 29' ' ' CYS . 3.5 t80 -52.37 -48.3 65.67 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.547 1.139 . . . . 74.42 111.045 172.365 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.447 ' HG3' ' O ' ' A' ' 54' ' ' SER . 49.6 mt-30 -66.74 -34.51 78.0 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 115.851 -0.613 . . . . 74.12 111.532 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.425 ' HG2' ' O ' ' A' ' 55' ' ' GLU . 11.7 mm-40 -69.96 -33.36 71.99 Favored 'General case' 0 N--CA 1.486 1.345 0 CA-C-O 120.893 0.378 . . . . 75.43 110.579 177.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 32.8 mt -62.38 -41.91 99.0 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.059 0.944 . . . . 74.21 111.331 170.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 34.5 mmt . . . . . 0 N--CA 1.489 1.482 0 C-N-CA 123.388 0.675 . . . . 74.4 111.057 175.02 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 79.3 m95 . . . . . 0 N--CA 1.478 0.934 0 N-CA-C 109.851 -0.426 . . . . 74.41 109.851 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 19.4 p -108.48 168.29 9.43 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 122.245 -0.284 . . . . 74.41 110.684 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 24.1 ptt-85 -53.85 -21.78 8.38 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 124.401 1.081 . . . . 74.34 112.912 176.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -74.14 -49.6 23.04 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.359 0.664 . . . . 74.2 110.329 175.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -60.29 -58.95 6.34 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.895 0.878 . . . . 71.02 111.768 -178.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.549 ' HB2' HD23 ' A' ' 60' ' ' LEU . 2.1 p30 -66.2 -31.67 72.63 Favored 'General case' 0 CA--C 1.558 1.282 0 N-CA-C 113.268 0.84 . . . . 74.42 113.268 -172.492 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 34.9 ttt180 -60.23 -44.06 95.52 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 123.487 0.715 . . . . 73.31 111.64 173.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 80.3 t -66.52 -37.61 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 C-N-CA 123.225 0.61 . . . . 75.03 111.201 177.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 78.1 mt -58.13 -56.2 17.45 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 122.749 0.42 . . . . 74.13 111.151 176.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.573 ' HG ' HD12 ' A' ' 60' ' ' LEU . 78.5 mt -57.99 -37.32 74.02 Favored 'General case' 0 N--CA 1.484 1.231 0 N-CA-C 112.322 0.49 . . . . 63.12 112.322 179.148 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 46.4 tp -63.65 -51.56 64.63 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.591 0.756 . . . . 74.34 112.447 -178.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -77.97 -22.24 49.72 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 112.679 0.622 . . . . 74.53 112.679 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 80.3 m -75.35 -41.66 56.05 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 112.215 0.45 . . . . 74.32 112.215 177.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -70.14 -29.25 66.13 Favored 'General case' 0 N--CA 1.491 1.625 0 C-N-CA 122.711 0.404 . . . . 74.43 111.204 175.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -73.98 -66.9 0.66 Allowed 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 124.045 0.938 . . . . 73.51 111.212 177.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 60.7 mtt-85 -80.41 -56.85 3.9 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.193 0.997 . . . . 73.24 111.328 -171.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 129.71 154.78 8.23 Favored Glycine 0 CA--C 1.538 1.523 0 CA-C-O 119.356 -0.691 . . . . 72.32 112.499 -177.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_exo -65.46 94.3 0.25 Allowed 'Trans proline' 0 C--N 1.377 2.042 0 C-N-CA 123.27 2.647 . . . . 74.43 112.684 176.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 67.3 m -142.24 155.64 45.26 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 124.07 0.948 . . . . 74.13 110.587 -178.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 91.2 p -59.92 -40.31 88.43 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 123.319 0.647 . . . . 63.42 112.411 -176.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 38.6 mtmm -68.37 -24.41 64.79 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.041 0.537 . . . . 73.14 112.337 176.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 68.5 m -78.19 -43.05 29.59 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 109.225 -0.657 . . . . 64.32 109.225 -179.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -72.07 -29.19 63.89 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 115.267 -0.879 . . . . 73.24 111.563 176.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.15 -34.72 61.65 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.518 0.727 . . . . 74.02 111.329 174.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 86.2 t80 -63.91 -48.53 76.25 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 122.995 0.518 . . . . 73.41 110.392 172.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.413 ' HB2' HG12 ' A' ' 53' ' ' VAL . 81.7 mt -66.36 -27.28 67.76 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.26 1.024 . . . . 72.02 112.109 176.255 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.83 -42.32 86.02 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.074 0.55 . . . . 72.54 111.207 172.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.42 -34.88 68.17 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.157 0.583 . . . . 61.31 111.478 175.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 58.8 tptt -67.21 -40.25 86.41 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.843 1.257 . . . . 75.44 111.358 -179.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 46.8 mt -109.26 12.23 24.96 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.807 0.843 . . . . 74.01 112.263 -175.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.7 p30 49.49 22.77 0.78 Allowed 'General case' 0 N--CA 1.51 2.527 0 C-N-CA 126.327 1.851 . . . . 74.34 114.75 -175.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 44.9 mmtm -99.67 -172.17 2.2 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.838 0.855 . . . . 72.5 111.319 179.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 -98.71 145.57 30.15 Favored Pre-proline 0 N--CA 1.489 1.512 0 C-N-CA 123.495 0.718 . . . . 73.25 110.52 176.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_exo -57.76 -32.73 95.54 Favored 'Trans proline' 0 C--N 1.387 2.558 0 C-N-CA 123.293 2.662 . . . . 61.11 113.839 -178.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -61.46 -48.93 78.89 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.998 0.919 . . . . 71.04 111.25 174.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -63.3 -41.35 98.95 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.822 0.849 . . . . 75.42 111.396 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.413 HG12 ' HB2' ' A' ' 42' ' ' LEU . 93.9 t -65.49 -42.99 94.51 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 C-N-CA 123.878 0.871 . . . . 74.55 111.441 177.787 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 37.8 t -64.2 -44.14 92.88 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.69 0.796 . . . . 73.34 111.904 -178.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.405 ' O ' ' HG3' ' A' ' 59' ' ' GLN . 47.4 mt-10 -65.97 -42.7 89.58 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.229 0.612 . . . . 62.24 111.327 174.431 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 32.2 tpt180 -60.86 -41.76 96.53 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.284 0.633 . . . . 73.24 111.414 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -53.08 -48.27 67.88 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 124.247 1.019 . . . . 72.13 111.385 173.062 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -75.17 -24.67 57.92 Favored 'General case' 0 CA--C 1.555 1.145 0 CA-C-N 115.168 -0.923 . . . . 75.2 112.315 -178.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.405 ' HG3' ' O ' ' A' ' 55' ' ' GLU . 98.0 mt-30 -68.36 -45.03 73.9 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 109.448 -0.575 . . . . 73.34 109.448 171.579 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.573 HD12 ' HG ' ' A' ' 26' ' ' LEU . 31.6 mt -56.01 -56.37 21.58 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.381 1.072 . . . . 72.44 111.75 175.464 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' MET . . . . . 0.564 ' HA ' ' HE1' ' A' ' 61' ' ' MET . 17.2 mmt . . . . . 0 N--CA 1.481 1.095 0 N-CA-C 112.696 0.628 . . . . 72.42 112.696 -178.102 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . 0.421 ' HH2' HG22 ' A' ' 53' ' ' VAL . 90.8 m95 . . . . . 0 CA--C 1.551 0.99 0 N-CA-C 110.545 -0.169 . . . . 75.35 110.545 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 44.5 p -116.89 169.82 9.09 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 123.092 0.557 . . . . 72.25 110.222 176.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 16.7 ptt180 -57.81 -20.84 38.58 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 112.32 0.489 . . . . 72.24 112.32 177.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.413 ' O ' HG22 ' A' ' 24' ' ' VAL . 27.2 m-80 -70.19 -50.63 38.22 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.227 0.611 . . . . 73.43 110.391 175.453 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.461 ' HA ' HD21 ' A' ' 46' ' ' LEU . 16.5 m-20 -65.12 -54.8 24.36 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.239 0.616 . . . . 64.42 111.068 -179.712 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.567 ' HB3' HD22 ' A' ' 60' ' ' LEU . 1.2 m-20 -54.76 -39.38 68.27 Favored 'General case' 0 CA--C 1.559 1.295 0 C-N-CA 124.915 1.286 . . . . 74.22 113.223 -179.384 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 17.5 tpt180 -65.2 -44.81 87.14 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 122.512 0.325 . . . . 74.42 111.484 177.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.413 HG22 ' O ' ' A' ' 20' ' ' ASN . 57.7 t -67.69 -31.02 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 C-N-CA 122.787 0.435 . . . . 73.51 112.086 -176.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 87.9 mt -55.02 -56.41 11.14 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.417 0 CA-C-O 120.826 0.346 . . . . 63.31 110.432 169.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.401 HD13 ' HB3' ' A' ' 60' ' ' LEU . 68.2 mt -65.22 -28.87 69.67 Favored 'General case' 0 CA--C 1.556 1.209 0 C-N-CA 123.314 0.645 . . . . 75.3 112.198 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 61.1 tp -69.11 -48.81 61.55 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.432 0.693 . . . . 65.31 111.518 177.165 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.416 ' HA ' ' HB3' ' A' ' 31' ' ' LYS . 11.2 mm-40 -76.81 -19.19 57.84 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.115 0.566 . . . . 73.43 112.436 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 98.6 m -74.62 -33.25 62.53 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 112.104 0.409 . . . . 74.44 112.104 174.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -85.37 -24.04 27.74 Favored 'General case' 0 N--CA 1.493 1.712 0 C-N-CA 122.481 0.313 . . . . 75.12 111.413 172.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.416 ' HB3' ' HA ' ' A' ' 28' ' ' GLU . 60.6 tptt -84.26 -71.57 0.51 Allowed 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.721 0.808 . . . . 75.52 110.953 179.196 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.468 ' HD3' HG21 ' A' ' 38' ' ' THR . 39.9 ttt180 -79.11 -42.52 26.1 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 124.489 1.115 . . . . 74.54 111.824 -176.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 125.62 147.66 7.02 Favored Glycine 0 CA--C 1.54 1.6 0 CA-C-O 119.317 -0.713 . . . . 53.22 112.849 179.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -73.75 107.48 2.42 Favored 'Trans proline' 0 C--N 1.378 2.085 0 C-N-CA 123.114 2.543 . . . . 75.01 112.118 178.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 48.5 t -156.1 151.24 26.5 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.419 0.688 . . . . 60.12 110.814 -178.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 64.7 p -64.13 -27.79 69.33 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 122.928 0.491 . . . . 75.43 111.32 175.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 40.4 tttm -72.83 -21.66 60.92 Favored 'General case' 0 CA--C 1.561 1.376 0 C-N-CA 123.986 0.914 . . . . 74.4 110.665 175.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.468 HG21 ' HD3' ' A' ' 32' ' ' ARG . 81.5 m -86.96 -34.37 19.34 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 124.318 1.047 . . . . 74.45 110.015 173.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.436 ' HD1' HD13 ' A' ' 42' ' ' LEU . 21.5 m-85 -71.38 -28.34 63.97 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.434 0.694 . . . . 75.12 111.836 -179.868 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.501 ' HA ' ' HG3' ' A' ' 50' ' ' PRO . . . -67.98 -32.34 72.69 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.252 0.621 . . . . 75.44 111.44 170.477 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 50.2 t80 -76.05 -38.47 57.1 Favored 'General case' 0 CA--C 1.558 1.279 0 C-N-CA 123.596 0.758 . . . . 74.41 111.291 175.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.485 HD21 ' HD2' ' A' ' 45' ' ' LYS . 68.7 mt -66.31 -29.34 69.53 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.969 0.908 . . . . 75.42 111.263 173.335 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.57 -45.07 88.62 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 123.268 0.627 . . . . 72.32 111.203 171.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.07 -53.58 56.09 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 123.661 0.784 . . . . 73.22 112.585 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.568 ' HG3' ' HG ' ' A' ' 46' ' ' LEU . 0.2 OUTLIER -71.0 -40.23 71.94 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 112.889 0.7 . . . . 72.44 112.889 -175.844 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.568 ' HG ' ' HG3' ' A' ' 45' ' ' LYS . 81.6 mt -92.87 14.15 18.32 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 112.964 0.727 . . . . 75.42 112.964 -174.56 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.1 p30 51.2 22.45 1.34 Allowed 'General case' 0 N--CA 1.503 2.206 0 C-N-CA 125.951 1.7 . . . . 73.44 114.562 -176.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.408 ' HG2' ' O ' ' A' ' 46' ' ' LEU . 47.6 mmtm -101.72 -166.34 1.29 Allowed 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.948 0.899 . . . . 75.03 111.229 -179.587 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -127.45 146.62 59.01 Favored Pre-proline 0 CA--C 1.564 1.481 0 C-N-CA 123.259 0.624 . . . . 75.12 110.248 -179.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.501 ' HG3' ' HA ' ' A' ' 40' ' ' ALA . 59.3 Cg_exo -52.45 -38.81 74.85 Favored 'Trans proline' 0 C--N 1.389 2.668 0 C-N-CA 124.037 3.158 . . . . 74.31 115.71 -170.901 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 46.6 t-20 -59.28 -44.83 92.44 Favored 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 123.306 0.643 . . . . 74.45 110.713 177.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -67.0 -43.07 83.86 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.938 0.895 . . . . 71.13 110.777 -177.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.421 HG22 ' HH2' ' A' ' 17' ' ' TRP . 52.9 t -65.19 -45.81 92.77 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 CA-C-N 115.152 -0.931 . . . . 75.4 111.761 -178.879 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 80.8 p -64.3 -40.4 95.88 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.516 0.727 . . . . 75.14 111.724 -177.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -63.6 -49.59 72.74 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 116.043 -0.526 . . . . 71.43 111.176 172.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 10.9 tpt85 -60.83 -37.53 82.34 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 115.858 -0.61 . . . . 74.23 111.466 -174.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 29.1 t80 -53.13 -53.65 47.37 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 124.529 1.132 . . . . 72.24 112.881 176.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -73.82 -24.58 59.81 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 122.906 0.482 . . . . 73.21 111.968 -175.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 82.7 mm-40 -69.97 -42.71 72.78 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.121 0.568 . . . . 74.13 109.795 170.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.567 HD22 ' HB3' ' A' ' 22' ' ' ASP . 17.7 mt -61.71 -51.99 66.1 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.736 1.214 . . . . 54.12 112.542 -178.232 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' MET . . . . . 0.526 ' HA ' ' HE1' ' A' ' 61' ' ' MET . 5.7 mmt . . . . . 0 N--CA 1.485 1.32 0 N-CA-C 112.244 0.461 . . . . 74.25 112.244 179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 86.4 m95 . . . . . 0 N--CA 1.489 1.506 0 N-CA-C 110.547 -0.168 . . . . 74.33 110.547 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 25.1 p -119.98 159.1 25.39 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.93 0.892 . . . . 75.05 110.259 177.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 8.7 ptp85 -64.29 -20.75 66.29 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 123.704 0.802 . . . . 72.32 112.205 174.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -67.7 -44.88 76.69 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.933 0.893 . . . . 73.54 110.312 173.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -59.48 -44.95 92.92 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 123.495 0.718 . . . . 74.11 111.772 177.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 61.4 m-20 -54.33 -44.13 71.81 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 124.859 1.264 . . . . 72.41 112.66 179.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 61.2 ttp180 -59.62 -43.68 93.7 Favored 'General case' 0 CA--C 1.556 1.184 0 CA-C-N 115.823 -0.626 . . . . 74.34 111.563 177.044 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.6 t -69.28 -38.95 78.45 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 C-N-CA 123.582 0.753 . . . . 73.12 111.534 -177.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 90.2 mt -63.72 -52.24 59.78 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 C-N-CA 122.819 0.447 . . . . 74.24 111.012 177.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 97.6 mt -58.43 -34.92 71.33 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.129 0.572 . . . . 73.02 111.813 175.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 35.2 tp -63.48 -55.28 25.37 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.183 0.593 . . . . 72.14 111.121 178.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 54.6 mm-40 -72.43 -23.77 61.12 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 112.874 0.694 . . . . 75.45 112.874 -176.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 91.3 m -69.71 -30.01 67.54 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 122.719 0.408 . . . . 60.51 111.238 175.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -86.69 -33.31 20.09 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 123.601 0.76 . . . . 75.34 111.8 174.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 50.9 mtpt -75.16 -74.9 0.19 Allowed 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 123.493 0.717 . . . . 73.42 111.651 178.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 27.2 mtp180 -79.91 -36.93 35.7 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 124.175 0.99 . . . . 72.42 110.353 -172.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 122.07 160.4 10.95 Favored Glycine 0 CA--C 1.538 1.497 0 CA-C-N 115.363 -0.835 . . . . 72.23 111.967 -176.425 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -77.64 38.24 0.66 Allowed 'Trans proline' 0 CA--C 1.563 1.937 0 C-N-CA 123.568 2.845 . . . . 71.54 113.593 176.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 34.8 t -75.7 154.24 36.58 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.709 0.804 . . . . 71.21 111.788 179.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 98.3 p -61.33 -34.53 75.41 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.847 0.859 . . . . 72.01 111.877 178.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt -74.46 -19.51 60.36 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.256 0.622 . . . . 74.53 112.015 177.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 51.6 m -78.17 -33.91 49.91 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 109.183 -0.673 . . . . 65.44 109.183 173.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -70.64 -30.96 67.72 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.429 0.692 . . . . 72.22 111.245 173.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.96 -36.12 77.53 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.339 0.656 . . . . 70.34 111.566 171.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 82.4 t80 -63.57 -48.68 76.46 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 123.303 0.641 . . . . 73.35 110.704 171.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.428 ' HB2' HG11 ' A' ' 53' ' ' VAL . 59.9 mt -66.77 -23.05 66.03 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 124.603 1.161 . . . . 71.24 112.303 178.218 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.87 -53.52 49.18 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.102 0.561 . . . . 73.33 111.172 171.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -71.54 -28.21 63.72 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.09 0.556 . . . . 72.35 112.436 179.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.8 -47.32 47.52 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.508 0.723 . . . . 75.41 111.247 178.686 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 52.1 mt -101.22 5.22 42.48 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.449 0.7 . . . . 71.24 112.444 -172.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 61.65 29.67 18.25 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 124.304 1.042 . . . . 72.53 112.217 -177.008 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.0 mmtm -104.0 -165.81 1.19 Allowed 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 124.565 1.146 . . . . 73.41 110.434 178.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -119.96 145.59 40.09 Favored Pre-proline 0 N--CA 1.489 1.49 0 CA-C-O 118.36 -0.829 . . . . 71.34 110.43 178.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -50.78 -46.03 32.44 Favored 'Trans proline' 0 C--N 1.385 2.487 0 C-N-CA 123.638 2.892 . . . . 75.02 114.801 -174.395 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -66.31 -41.59 89.47 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.643 0.777 . . . . 62.34 111.13 179.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -67.22 -34.7 78.03 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.725 0.81 . . . . 75.35 111.995 -178.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.428 HG11 ' HB2' ' A' ' 42' ' ' LEU . 60.6 t -71.77 -38.9 67.52 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 C-N-CA 123.016 0.526 . . . . 74.53 110.583 174.041 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.2 t -59.91 -44.46 94.26 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.954 0.901 . . . . 73.04 111.093 177.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -63.65 -43.9 95.39 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.06 0.544 . . . . 64.4 110.986 173.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 23.5 tpt180 -63.68 -35.22 79.82 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.629 0.772 . . . . 72.43 112.666 -176.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -54.71 -47.47 73.69 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.601 0.761 . . . . 74.22 110.873 171.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -73.95 -24.29 59.62 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 115.191 -0.913 . . . . 74.45 112.04 -178.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -70.19 -38.04 75.24 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.111 0.564 . . . . 73.31 110.173 172.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 31.7 mt -60.87 -53.55 56.0 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.179 0.992 . . . . 74.34 111.577 175.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 90.1 mmm . . . . . 0 N--CA 1.484 1.237 0 C-N-CA 122.954 0.502 . . . . 71.32 111.651 178.422 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . 0.459 ' CH2' ' HG3' ' A' ' 48' ' ' LYS . 96.8 m95 . . . . . 0 N--CA 1.481 1.075 0 N-CA-C 110.238 -0.282 . . . . 73.11 110.238 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 82.1 p -128.75 170.22 13.57 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 123.345 0.658 . . . . 72.1 111.304 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 39.5 ptt180 -52.76 -29.71 28.75 Favored 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 124.807 1.243 . . . . 73.15 113.576 -175.054 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.422 ' O ' HG23 ' A' ' 24' ' ' VAL . 18.3 m120 -77.87 -44.46 27.09 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 123.284 0.634 . . . . 75.31 111.714 177.677 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -59.5 -49.78 76.46 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 122.983 0.513 . . . . 64.11 111.582 -178.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.643 ' HB2' HD22 ' A' ' 60' ' ' LEU . 2.9 p30 -68.72 -32.45 72.26 Favored 'General case' 0 CA--C 1.558 1.282 0 CA-C-N 115.519 -0.764 . . . . 71.31 112.243 -177.769 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -63.85 -37.41 87.28 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 123.302 0.641 . . . . 75.44 111.296 173.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 20' ' ' ASN . 86.4 t -69.0 -38.03 77.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 C-N-CA 123.242 0.617 . . . . 75.43 111.298 176.338 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 81.9 mt -55.96 -57.49 8.15 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 C-N-CA 122.439 0.295 . . . . 74.25 110.243 173.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.521 ' HG ' HD12 ' A' ' 60' ' ' LEU . 96.0 mt -60.12 -36.52 77.66 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.638 0.775 . . . . 74.32 112.517 178.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 42.5 tp -59.61 -59.07 6.03 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.138 0.575 . . . . 72.22 110.701 -179.006 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -70.69 -25.54 63.02 Favored 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 123.338 0.655 . . . . 71.33 112.536 -179.552 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 90.4 m -73.66 -36.79 65.41 Favored 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 112.353 0.501 . . . . 61.42 112.353 178.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -81.5 -30.71 33.19 Favored 'General case' 0 N--CA 1.492 1.627 0 CA-C-O 121.378 0.609 . . . . 72.25 111.03 176.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -72.17 -46.66 55.44 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 125.147 1.379 . . . . 73.43 112.522 178.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 53.3 mtp180 -114.78 -25.08 8.39 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 123.91 0.884 . . . . 75.44 112.722 -170.353 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 108.65 129.13 5.87 Favored Glycine 0 N--CA 1.479 1.52 0 CA-C-O 118.915 -0.936 . . . . 54.22 111.879 -173.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -74.2 85.43 1.4 Allowed 'Trans proline' 0 C--N 1.377 2.053 0 C-N-CA 122.618 2.212 . . . . 75.41 112.684 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 18.0 t -141.19 -179.24 5.99 Favored 'General case' 0 N--CA 1.482 1.159 0 CA-C-N 115.42 -0.809 . . . . 75.45 110.496 178.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 84.0 p -58.8 -36.44 74.45 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 114.156 1.169 . . . . 74.41 114.156 -169.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -70.0 -27.49 64.74 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 123.004 0.522 . . . . 74.22 111.866 -178.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 70.4 m -85.66 -43.76 13.16 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.437 0.695 . . . . 63.05 109.987 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -67.84 -29.29 68.39 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.363 0.665 . . . . 75.11 112.051 178.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.19 -39.92 90.03 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 122.918 0.487 . . . . 75.5 111.211 173.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 66.8 t80 -65.41 -51.09 62.75 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 116.077 -0.511 . . . . 72.24 110.686 174.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 79.4 mt -59.64 -31.02 69.14 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 124.362 1.065 . . . . 75.35 112.56 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.71 -56.04 14.18 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.344 0.657 . . . . 72.15 111.022 172.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.82 -25.8 68.07 Favored 'General case' 0 CA--C 1.56 1.363 0 C-N-CA 123.655 0.782 . . . . 74.34 112.617 178.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -76.89 -52.11 10.04 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 124.124 0.97 . . . . 74.22 111.34 -177.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 51.4 mt -91.19 -2.42 57.51 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 124.082 0.953 . . . . 75.21 111.904 -176.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.5 t70 69.25 33.5 3.25 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 125.312 1.445 . . . . 72.23 111.425 -177.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.459 ' HG3' ' CH2' ' A' ' 17' ' ' TRP . 67.9 mmtt -105.33 -167.18 1.3 Allowed 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 124.489 1.116 . . . . 74.33 110.749 177.289 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -118.71 149.04 45.63 Favored Pre-proline 0 N--CA 1.489 1.523 0 C-N-CA 123.751 0.82 . . . . 72.4 109.996 171.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -51.36 -42.1 56.27 Favored 'Trans proline' 0 C--N 1.387 2.556 0 C-N-CA 123.689 2.926 . . . . 74.22 115.761 -172.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -65.27 -39.73 93.0 Favored 'General case' 0 N--CA 1.494 1.733 0 C-N-CA 122.621 0.368 . . . . 74.31 111.437 177.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.442 ' O ' ' HD3' ' A' ' 56' ' ' ARG . 79.7 mt-30 -65.79 -31.18 72.01 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.552 0.741 . . . . 72.04 111.234 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 95.7 t -74.89 -46.95 39.28 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.145 0 C-N-CA 123.517 0.727 . . . . 72.12 111.016 175.168 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 35.0 t -64.73 -36.13 83.3 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 124.103 0.961 . . . . 75.24 112.801 -174.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -71.94 -39.31 69.5 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 122.671 0.388 . . . . 72.43 111.874 177.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.442 ' HD3' ' O ' ' A' ' 52' ' ' GLN . 5.7 mpt_? -69.53 -29.39 66.98 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 122.647 0.379 . . . . 74.34 111.026 176.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.503 ' HA ' HD13 ' A' ' 60' ' ' LEU . 8.2 t80 -55.37 -43.8 75.46 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.705 0.802 . . . . 75.44 111.019 168.661 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -74.75 -25.13 58.88 Favored 'General case' 0 CA--C 1.558 1.257 0 C-N-CA 123.47 0.708 . . . . 71.41 112.38 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -74.36 -31.85 62.55 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.346 0.593 . . . . 64.05 110.244 171.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.643 HD22 ' HB2' ' A' ' 22' ' ' ASP . 38.6 mt -65.83 -34.82 79.03 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.189 0.996 . . . . 72.24 111.482 172.621 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 33.8 mmt . . . . . 0 N--CA 1.482 1.15 0 C-N-CA 123.008 0.523 . . . . 74.11 111.564 175.204 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 82.4 m95 . . . . . 0 N--CA 1.477 0.889 0 CA-C-O 120.607 0.242 . . . . 75.44 110.802 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 30.1 p -97.03 155.95 16.57 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 108.324 -0.991 . . . . 70.22 108.324 171.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 35.3 ptt180 -58.93 -20.31 50.82 Favored 'General case' 0 CA--C 1.558 1.253 0 N-CA-C 112.237 0.458 . . . . 74.12 112.237 176.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -71.19 -40.49 71.19 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.969 0.908 . . . . 65.3 111.472 175.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.429 ' HA ' HD22 ' A' ' 46' ' ' LEU . 28.9 m-20 -60.54 -61.65 2.43 Favored 'General case' 0 N--CA 1.487 1.378 0 CA-C-O 121.49 0.662 . . . . 75.14 111.281 176.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.548 ' HB2' HD11 ' A' ' 60' ' ' LEU . 1.7 p30 -64.91 -28.67 69.69 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 113.624 0.972 . . . . 64.43 113.624 -174.231 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 28.2 tpt85 -56.21 -38.67 71.34 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 123.03 0.532 . . . . 74.11 111.921 173.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 44.0 t -72.9 -31.54 36.4 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 123.332 0.653 . . . . 73.35 111.184 177.059 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 66.0 mt -59.86 -47.19 92.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 C-N-CA 122.527 0.331 . . . . 65.11 110.34 172.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.406 HD22 ' HB3' ' A' ' 60' ' ' LEU . 97.4 mt -56.26 -38.96 71.86 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.741 0.817 . . . . 74.14 112.002 175.181 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 57.8 tp -63.81 -59.17 4.88 Favored 'General case' 0 CA--C 1.556 1.175 0 C-N-CA 123.419 0.688 . . . . 75.45 111.739 179.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -69.95 -22.15 63.2 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 113.236 0.828 . . . . 70.43 113.236 -175.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 65.7 m -69.8 -30.09 67.54 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 122.458 0.303 . . . . 63.34 111.415 173.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -84.19 -39.17 19.69 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 122.965 0.506 . . . . 75.32 111.026 174.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -61.44 -64.36 0.97 Allowed 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.975 0.91 . . . . 75.54 111.789 178.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.483 ' HD2' HG21 ' A' ' 38' ' ' THR . 37.5 mtt-85 -91.07 -52.19 4.96 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.74 0.816 . . . . 72.14 110.976 -174.368 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 131.08 147.1 5.97 Favored Glycine 0 CA--C 1.534 1.249 0 CA-C-N 115.157 -0.929 . . . . 72.4 111.391 -173.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -61.06 95.61 0.12 Allowed 'Trans proline' 0 C--N 1.374 1.869 0 C-N-CA 122.894 2.396 . . . . 73.42 112.445 175.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 48.3 t -146.95 157.06 43.52 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.985 0.914 . . . . 72.14 110.531 -175.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 81.0 p -65.34 -31.94 73.33 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.457 0.703 . . . . 73.53 112.407 -177.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -69.95 -26.66 64.22 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 123.286 0.634 . . . . 72.34 111.726 174.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.483 HG21 ' HD2' ' A' ' 32' ' ' ARG . 97.3 m -77.97 -42.99 31.01 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.759 0.823 . . . . 72.1 109.152 177.161 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -63.86 -28.81 70.1 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 124.028 0.931 . . . . 73.04 111.318 173.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.562 ' HA ' ' HG3' ' A' ' 50' ' ' PRO . . . -69.24 -42.35 75.75 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.372 0.669 . . . . 74.42 111.522 175.705 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -59.71 -49.41 77.84 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-O 121.077 0.465 . . . . 70.13 110.51 171.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 64.9 mt -63.74 -23.97 67.58 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.537 1.135 . . . . 74.23 112.741 178.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.77 -53.95 33.66 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.127 0.571 . . . . 73.45 110.727 172.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.27 -35.29 80.58 Favored 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 123.308 0.643 . . . . 75.43 111.635 177.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 58.2 tptt -66.93 -49.7 64.71 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.542 1.137 . . . . 75.42 111.693 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.429 HD22 ' HA ' ' A' ' 21' ' ' ASP . 64.9 mt -96.1 -2.15 47.14 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 113.013 0.746 . . . . 74.4 113.013 -172.715 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 79.88 -1.21 2.1 Favored 'General case' 0 N--CA 1.505 2.312 0 C-N-CA 126.117 1.767 . . . . 74.42 113.398 -178.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -88.88 -168.02 2.06 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 112.31 0.485 . . . . 71.31 112.31 -179.532 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -108.43 152.73 42.17 Favored Pre-proline 0 N--CA 1.484 1.248 0 C-N-CA 124.229 1.012 . . . . 75.04 110.126 173.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.562 ' HG3' ' HA ' ' A' ' 40' ' ' ALA . 37.4 Cg_exo -57.17 -34.17 97.26 Favored 'Trans proline' 0 C--N 1.39 2.72 0 C-N-CA 123.439 2.759 . . . . 74.21 114.203 -172.37 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.418 ' O ' ' HG3' ' A' ' 55' ' ' GLU . 18.3 m120 -67.78 -39.75 84.06 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.372 0.669 . . . . 65.24 111.497 177.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -66.33 -42.22 88.49 Favored 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 123.225 0.61 . . . . 73.52 110.453 177.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 82.0 t -57.58 -41.15 78.47 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 124.314 1.046 . . . . 65.05 111.049 173.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.506 ' O ' ' HG3' ' A' ' 58' ' ' GLN . 34.3 t -65.59 -41.25 93.05 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.152 0.581 . . . . 70.53 111.503 178.422 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.418 ' HG3' ' O ' ' A' ' 51' ' ' ASN . 52.0 mt-10 -57.98 -49.55 76.44 Favored 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 123.049 0.54 . . . . 61.24 111.142 176.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.4 tpm_? -62.16 -39.1 91.5 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 124.169 0.988 . . . . 71.51 111.818 176.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.416 ' HA ' HD13 ' A' ' 60' ' ' LEU . 16.0 t80 -56.14 -49.77 73.01 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 124.59 1.156 . . . . 71.02 112.252 177.288 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.506 ' HG3' ' O ' ' A' ' 54' ' ' SER . 62.3 mt-30 -68.59 -25.83 65.07 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.479 0.711 . . . . 73.11 111.439 -176.391 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 71.2 mt-30 -71.31 -47.73 54.96 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 115.427 -0.806 . . . . 75.43 109.668 171.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.548 HD11 ' HB2' ' A' ' 22' ' ' ASP . 58.2 mt -52.93 -46.65 68.2 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 124.497 1.119 . . . . 63.33 112.603 178.34 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 33.9 mmt . . . . . 0 N--CA 1.482 1.14 0 C-N-CA 123.102 0.561 . . . . 75.03 111.822 -179.155 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 95.4 m95 . . . . . 0 N--CA 1.484 1.273 0 N-CA-C 110.025 -0.361 . . . . 75.44 110.025 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 27.1 p -106.03 166.88 10.18 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.2 0.6 . . . . 74.22 109.845 179.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.47 -20.77 66.39 Favored 'General case' 0 CA--C 1.552 1.048 0 CA-C-N 115.923 -0.58 . . . . 74.13 112.461 175.784 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -73.13 -43.33 61.78 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.651 0.78 . . . . 65.15 110.66 173.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -57.84 -44.95 86.82 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.893 0.477 . . . . 74.13 110.848 171.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 -56.64 -53.13 61.19 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 124.111 0.964 . . . . 73.21 111.511 176.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 19.8 tpp180 -55.64 -47.76 76.11 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.911 0.884 . . . . 75.15 111.636 179.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 82.2 t -66.64 -43.7 90.2 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.152 0 C-N-CA 122.936 0.494 . . . . 72.42 112.137 -177.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 73.4 mt -56.79 -53.01 47.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 CA-C-N 118.324 0.511 . . . . 74.44 111.18 175.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.434 HD13 HD21 ' A' ' 60' ' ' LEU . 73.3 mt -61.25 -37.49 83.28 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 123.789 0.836 . . . . 74.41 112.231 -179.53 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 36.2 tp -73.78 -58.15 3.5 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.336 0.654 . . . . 73.14 111.734 -176.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.595 ' HB2' HD22 ' A' ' 42' ' ' LEU . 4.2 mm-40 -66.89 -23.51 66.01 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.141 0.576 . . . . 74.13 112.1 -175.286 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 99.2 m -70.77 -29.92 66.26 Favored 'General case' 0 N--CA 1.493 1.715 0 C-N-CA 122.932 0.493 . . . . 73.23 111.742 172.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -77.58 -25.89 50.34 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.874 -0.517 . . . . 74.34 111.438 172.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.1 mpmm? -76.17 -62.74 1.51 Allowed 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.59 0.756 . . . . 73.32 111.633 178.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 7.4 mpt_? -93.13 -2.73 55.09 Favored 'General case' 0 N--CA 1.49 1.525 0 N-CA-C 112.826 0.676 . . . . 74.41 112.826 -174.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.73 146.22 18.6 Favored Glycine 0 N--CA 1.487 2.041 0 CA-C-O 119.095 -0.836 . . . . 65.3 112.602 -173.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -77.49 43.05 1.25 Allowed 'Trans proline' 0 C--N 1.376 1.991 0 C-N-CA 123.373 2.715 . . . . 71.32 113.543 -177.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 42.6 m -97.35 168.68 10.26 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.18 0.992 . . . . 71.21 111.543 -177.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' SER . . . . . 0.425 ' HA ' ' HD2' ' A' ' 39' ' ' PHE . 89.9 p -61.1 -30.87 70.62 Favored 'General case' 0 N--CA 1.499 1.99 0 C-N-CA 123.35 0.66 . . . . 75.2 112.26 179.282 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 62.3 tttm -58.45 -28.24 65.11 Favored 'General case' 0 CA--C 1.559 1.318 0 C-N-CA 124.392 1.077 . . . . 71.31 112.165 175.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 59.4 m -93.26 -34.23 13.64 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.524 0.73 . . . . 73.33 110.959 -178.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . 0.425 ' HD2' ' HA ' ' A' ' 36' ' ' SER . 33.8 m-85 -62.54 -33.69 75.43 Favored 'General case' 0 N--CA 1.489 1.518 0 CA-C-O 121.153 0.501 . . . . 74.52 111.418 174.271 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.16 -41.36 94.78 Favored 'General case' 0 CA--C 1.557 1.234 0 C-N-CA 123.693 0.797 . . . . 73.22 111.493 173.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 77.0 t80 -62.34 -52.33 64.09 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.825 0.85 . . . . 72.51 111.209 174.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.595 HD22 ' HB2' ' A' ' 28' ' ' GLU . 80.7 mt -60.24 -31.37 70.13 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 125.094 1.357 . . . . 75.33 113.031 -178.764 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.37 -53.37 58.4 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.326 0.65 . . . . 72.23 111.639 175.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.56 -27.76 62.41 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 122.859 0.463 . . . . 53.32 111.968 177.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -72.66 -30.51 64.34 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 124.153 0.981 . . . . 74.21 111.787 -178.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 97.0 mt -116.33 4.66 13.46 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.618 0.767 . . . . 72.41 112.427 -177.36 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 61.34 27.53 17.16 Favored 'General case' 0 N--CA 1.497 1.9 0 C-N-CA 124.231 1.013 . . . . 74.5 112.594 -176.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -102.54 -174.67 2.62 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.369 1.067 . . . . 74.24 111.132 179.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -107.71 140.66 21.79 Favored Pre-proline 0 N--CA 1.486 1.353 0 C-N-CA 123.656 0.782 . . . . 74.2 109.402 175.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -56.43 -34.58 94.91 Favored 'Trans proline' 0 C--N 1.387 2.569 0 C-N-CA 123.105 2.536 . . . . 62.23 113.644 -172.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -60.35 -48.05 83.42 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.183 0.993 . . . . 73.52 111.024 175.12 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -72.97 -30.24 63.67 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.687 0.795 . . . . 73.23 111.681 -177.041 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 71.4 t -65.52 -44.03 94.14 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 123.292 0.637 . . . . 75.04 110.55 173.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 44.1 t -64.57 -42.97 95.29 Favored 'General case' 0 N--CA 1.485 1.302 0 CA-C-N 115.952 -0.567 . . . . 75.44 111.265 177.123 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -60.73 -44.47 96.6 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 123.576 0.751 . . . . 72.43 111.944 175.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 16.3 tpt180 -68.57 -39.15 81.12 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 122.642 0.377 . . . . 75.41 111.201 179.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -58.44 -53.03 62.97 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 124.063 0.945 . . . . 73.35 111.631 179.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 66.6 mt-30 -73.04 -26.7 61.39 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-N 115.324 -0.853 . . . . 73.31 111.226 -176.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 12.3 tm0? -69.7 -41.59 75.18 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 123.6 0.76 . . . . 72.21 109.366 173.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.434 HD21 HD13 ' A' ' 26' ' ' LEU . 13.0 mt -56.15 -48.13 76.87 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 124.355 1.062 . . . . 74.53 110.895 172.556 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' MET . . . . . 0.431 ' HA ' ' HE2' ' A' ' 61' ' ' MET . 29.2 mmt . . . . . 0 N--CA 1.485 1.291 0 C-N-CA 123.235 0.614 . . . . 74.2 111.22 176.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . 0.676 ' HZ2' ' HB3' ' A' ' 52' ' ' GLN . 81.6 m95 . . . . . 0 N--CA 1.477 0.924 0 N-CA-C 109.89 -0.411 . . . . 74.41 109.89 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 43.9 p -96.67 161.52 13.84 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 122.814 0.446 . . . . 63.52 110.834 -178.177 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 35.0 ptt180 -57.65 -23.26 50.33 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.527 0.731 . . . . 74.51 111.904 171.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -69.69 -46.24 66.47 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 123.905 0.882 . . . . 75.44 110.73 175.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.4 m-20 -58.61 -47.09 85.52 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.017 0.527 . . . . 72.22 111.234 174.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.405 ' HB3' HD22 ' A' ' 60' ' ' LEU . 56.5 m-20 -55.94 -47.16 78.07 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.157 0.983 . . . . 75.25 112.254 176.844 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 32.3 ttm180 -61.57 -40.22 93.98 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.915 0.486 . . . . 72.51 112.016 179.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 85.4 t -69.27 -40.0 79.75 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 122.73 0.412 . . . . 72.45 111.643 178.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 81.3 mt -58.88 -43.58 88.75 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 CA-C-O 120.877 0.37 . . . . 72.23 110.991 175.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 88.5 mt -70.94 -35.04 72.04 Favored 'General case' 0 CA--C 1.555 1.149 0 C-N-CA 123.287 0.635 . . . . 73.53 111.694 176.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 31.0 tp -67.27 -52.0 46.11 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.862 0.865 . . . . 71.34 111.719 -176.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -74.42 -20.49 60.03 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.123 0.569 . . . . 65.15 111.684 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 53.4 t -72.08 -34.7 68.89 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 122.85 0.46 . . . . 75.04 111.174 171.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -79.74 -15.61 57.18 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.158 0.583 . . . . 72.53 111.423 172.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 56.2 tptt -80.78 -48.38 12.56 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 123.694 0.798 . . . . 73.34 110.94 175.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 50.6 mtt180 -106.46 -63.58 1.26 Allowed 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.737 0.815 . . . . 75.43 111.447 -178.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 136.7 154.1 6.66 Favored Glycine 0 CA--C 1.539 1.544 0 CA-C-O 119.086 -0.841 . . . . 71.12 111.694 -172.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_exo -57.68 109.08 0.43 Allowed 'Trans proline' 0 C--N 1.374 1.88 0 C-N-CA 123.128 2.552 . . . . 73.43 113.168 176.319 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 46.7 t -156.39 155.37 32.03 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.316 0.646 . . . . 71.43 111.371 -177.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 58.4 p -62.91 -33.47 75.4 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.547 0.739 . . . . 74.44 111.23 172.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -63.96 -33.85 76.65 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.516 0.726 . . . . 73.35 111.124 173.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 38.4 m -83.36 -27.98 29.29 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 123.276 0.63 . . . . 63.42 110.192 -176.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 22.5 m-30 -69.35 -36.29 76.73 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.242 0.617 . . . . 71.5 110.849 172.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.02 -39.84 87.12 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 123.451 0.7 . . . . 73.2 110.924 173.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -65.54 -39.52 91.84 Favored 'General case' 0 CA--C 1.557 1.242 0 C-N-CA 124.425 1.09 . . . . 73.12 111.876 176.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.445 ' HB2' HG12 ' A' ' 53' ' ' VAL . 39.5 mt -73.41 -29.28 62.49 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 124.168 0.987 . . . . 72.14 112.248 175.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.47 -39.18 93.77 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 122.867 0.467 . . . . 64.21 110.385 171.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -71.36 -43.27 67.24 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 123.52 0.728 . . . . 63.54 112.001 175.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -70.05 -39.91 75.41 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.937 0.895 . . . . 71.14 112.09 -172.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 91.9 mt -100.26 -3.48 31.33 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.601 0.761 . . . . 75.43 112.962 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 60.15 25.01 14.32 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 124.246 1.018 . . . . 72.44 112.311 -177.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 48.6 mmtm -94.43 171.9 8.53 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 124.197 0.999 . . . . 72.23 110.291 177.324 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 37.4 m-80 -75.62 145.05 78.17 Favored Pre-proline 0 N--CA 1.486 1.333 0 CA-C-O 118.944 -0.55 . . . . 74.32 110.127 174.359 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -60.42 -28.83 87.49 Favored 'Trans proline' 0 C--N 1.381 2.252 0 C-N-CA 122.443 2.096 . . . . 73.32 112.503 178.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -72.27 -39.53 68.3 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.283 1.033 . . . . 74.13 110.629 177.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.676 ' HB3' ' HZ2' ' A' ' 17' ' ' TRP . 24.3 mm-40 -63.73 -38.27 90.49 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.603 0.761 . . . . 75.51 111.906 173.419 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.445 HG12 ' HB2' ' A' ' 42' ' ' LEU . 69.6 t -69.64 -48.88 63.0 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 C-N-CA 123.268 0.627 . . . . 74.4 111.877 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 79.9 p -58.04 -42.72 86.0 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 123.117 0.567 . . . . 71.32 111.48 179.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -61.83 -52.58 63.58 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.989 0.516 . . . . 71.11 112.203 173.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 28.4 tpt180 -65.25 -31.3 72.39 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 122.896 0.479 . . . . 73.43 112.108 -174.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -57.27 -52.28 65.95 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.869 0.868 . . . . 73.41 110.847 171.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -73.77 -23.36 59.71 Favored 'General case' 0 CA--C 1.552 1.035 0 CA-C-N 115.472 -0.786 . . . . 64.04 112.219 -176.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 36.1 mm-40 -65.86 -46.94 76.6 Favored 'General case' 0 N--CA 1.484 1.259 0 N-CA-C 109.469 -0.567 . . . . 74.52 109.469 168.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.405 HD22 ' HB3' ' A' ' 22' ' ' ASP . 21.6 mt -58.62 -45.22 89.68 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.298 1.039 . . . . 72.44 112.304 175.77 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 36.0 mmt . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 121.261 0.553 . . . . 74.21 111.295 177.411 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 89.6 m95 . . . . . 0 N--CA 1.491 1.586 0 N-CA-C 110.061 -0.348 . . . . 75.15 110.061 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 15.8 p -101.59 165.78 11.05 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 109.902 -0.407 . . . . 71.54 109.902 173.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 20.2 ptp180 -66.55 -21.37 66.15 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.211 0.604 . . . . 75.22 111.281 177.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -75.58 -50.67 14.87 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.167 0.987 . . . . 74.43 110.097 179.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 52.7 m-20 -63.59 -42.31 98.28 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.132 0.573 . . . . 74.04 110.606 177.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -53.87 -50.42 66.31 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 125.034 1.334 . . . . 73.22 111.281 176.115 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.6 -29.14 65.47 Favored 'General case' 0 CA--C 1.558 1.257 0 CA-C-N 115.305 -0.861 . . . . 74.23 112.014 -178.724 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 53.7 t -68.93 -40.88 81.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 C-N-CA 122.717 0.407 . . . . 61.24 110.952 173.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 86.8 mt -56.99 -59.42 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.364 0 O-C-N 123.306 0.378 . . . . 73.02 110.288 175.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.548 HD13 HD21 ' A' ' 60' ' ' LEU . 83.9 mt -59.8 -34.1 72.59 Favored 'General case' 0 N--CA 1.485 1.302 0 N-CA-C 112.833 0.679 . . . . 71.41 112.833 -176.486 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 37.6 tp -75.93 -57.0 4.13 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.135 0.574 . . . . 75.42 112.255 -175.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.731 ' HB2' HD23 ' A' ' 42' ' ' LEU . 24.5 mt-10 -77.75 -18.81 56.1 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 112.893 0.701 . . . . 75.41 112.893 -176.49 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . 0.543 ' SG ' ' HA ' ' A' ' 34' ' ' PRO . 43.1 t -70.9 -51.01 28.8 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.635 0.374 . . . . 75.4 110.922 176.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -66.87 -27.91 67.91 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 122.863 0.465 . . . . 71.52 111.61 174.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 59.9 tptt -65.05 -50.08 67.61 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.814 0.845 . . . . 72.51 111.057 176.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 61.3 mtp85 -100.6 11.67 39.0 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 112.766 0.654 . . . . 74.41 112.766 -175.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 79.51 110.8 0.24 Allowed Glycine 0 CA--C 1.544 1.892 0 CA-C-O 118.762 -1.021 . . . . 72.13 112.377 178.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.543 ' HA ' ' SG ' ' A' ' 29' ' ' CYS . 20.1 Cg_endo -57.53 99.34 0.09 OUTLIER 'Trans proline' 0 C--N 1.382 2.32 0 C-N-CA 123.373 2.716 . . . . 62.43 113.691 -173.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 23.0 t -157.37 174.22 15.74 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.224 0.609 . . . . 74.23 112.004 -172.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 60.5 p -55.5 -50.33 70.22 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 124.78 1.232 . . . . 73.14 113.689 -175.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 26.5 mtpp -69.22 -15.13 63.31 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 112.9 0.704 . . . . 72.21 112.9 -178.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 27.5 m -87.31 -34.06 19.0 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.469 0.708 . . . . 60.34 109.693 177.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -66.67 -35.67 80.7 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.212 0.605 . . . . 73.2 110.847 173.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.41 -36.55 83.11 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.455 0.702 . . . . 61.51 111.775 175.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -63.24 -55.66 23.05 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.376 0.67 . . . . 71.23 111.216 172.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.731 HD23 ' HB2' ' A' ' 28' ' ' GLU . 81.2 mt -62.17 -23.25 66.48 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 124.177 0.991 . . . . 75.05 112.616 178.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.3 -57.7 8.63 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.347 0.659 . . . . 73.21 111.32 173.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.9 -30.67 71.3 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-N 115.876 -0.602 . . . . 75.05 111.666 178.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.411 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 0.5 OUTLIER -68.28 -42.87 78.89 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 123.703 0.801 . . . . 75.24 111.78 177.801 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 89.8 mt -104.25 12.85 33.2 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 123.485 0.714 . . . . 74.22 112.831 -175.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.2 t70 64.18 16.09 9.8 Favored 'General case' 0 CA--C 1.575 1.911 0 C-N-CA 124.064 0.946 . . . . 74.32 112.558 175.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -107.83 -175.11 2.69 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.777 0.831 . . . . 75.15 112.008 -178.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -91.65 150.98 41.93 Favored Pre-proline 0 N--CA 1.484 1.236 0 C-N-CA 123.302 0.641 . . . . 73.21 110.145 176.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 79.1 Cg_exo -52.59 -35.41 67.18 Favored 'Trans proline' 0 C--N 1.384 2.402 0 C-N-CA 122.857 2.371 . . . . 64.54 113.618 174.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -64.46 -46.9 81.13 Favored 'General case' 0 CA--C 1.557 1.248 0 C-N-CA 123.172 0.589 . . . . 73.31 110.43 176.379 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -54.78 -46.84 74.47 Favored 'General case' 0 N--CA 1.499 1.977 0 C-N-CA 123.743 0.817 . . . . 75.22 112.008 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.516 HG11 ' HB2' ' A' ' 42' ' ' LEU . 69.4 t -65.7 -45.41 92.06 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 CA-C-N 115.286 -0.87 . . . . 75.35 111.183 179.728 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' SER . . . . . 0.458 ' O ' ' HG3' ' A' ' 58' ' ' GLN . 35.0 t -58.09 -43.39 87.06 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.344 0.658 . . . . 74.15 111.6 177.286 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -62.09 -53.91 48.71 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.511 0.725 . . . . 73.2 111.64 178.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.403 ' HA ' ' HD2' ' A' ' 56' ' ' ARG . 10.7 tpt180 -61.59 -38.49 87.76 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 122.683 0.393 . . . . 75.42 111.621 -178.704 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -55.46 -52.62 63.02 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.853 0.861 . . . . 74.54 112.134 174.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.458 ' HG3' ' O ' ' A' ' 54' ' ' SER . 83.3 mt-30 -73.59 -24.39 60.06 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.326 0.65 . . . . 75.5 112.136 -175.493 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -68.3 -43.61 77.29 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 122.998 0.519 . . . . 63.23 109.641 170.113 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.548 HD21 HD13 ' A' ' 26' ' ' LEU . 14.3 mt -60.59 -45.55 93.53 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.285 1.034 . . . . 74.31 112.262 176.057 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 35.1 mmt . . . . . 0 N--CA 1.488 1.449 0 C-N-CA 123.364 0.666 . . . . 74.51 110.768 175.024 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . 0.548 ' HZ3' HD12 ' A' ' 46' ' ' LEU . 98.6 m95 . . . . . 0 N--CA 1.485 1.312 0 N-CA-C 110.414 -0.217 . . . . 75.33 110.414 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 18.0 p -122.2 158.16 30.02 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 109.259 -0.645 . . . . 71.12 109.259 170.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.6 ptp180 -63.24 -19.04 64.19 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 123.562 0.745 . . . . 74.01 112.673 176.541 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.446 ' O ' HG22 ' A' ' 24' ' ' VAL . 25.5 m-80 -68.55 -46.71 68.75 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.124 0.57 . . . . 75.24 109.755 170.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -62.92 -43.57 98.42 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 123.589 0.756 . . . . 74.5 111.24 176.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.634 ' HB3' HD22 ' A' ' 60' ' ' LEU . 68.7 m-20 -56.51 -42.68 78.8 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.742 1.217 . . . . 64.22 111.768 175.69 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 32.5 ttm180 -61.37 -45.68 93.35 Favored 'General case' 0 N--CA 1.483 1.186 0 CA-C-N 115.48 -0.782 . . . . 73.45 110.917 175.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.446 HG22 ' O ' ' A' ' 20' ' ' ASN . 78.2 t -62.34 -41.69 92.6 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 C-N-CA 123.988 0.915 . . . . 72.43 112.207 -177.835 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 88.6 mt -61.2 -52.86 56.5 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 C-N-CA 122.327 0.251 . . . . 72.42 110.803 177.429 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.486 ' HG ' HD12 ' A' ' 60' ' ' LEU . 94.1 mt -58.65 -37.08 75.19 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.489 0.716 . . . . 75.43 112.18 176.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 28.3 tp -74.82 -50.55 16.78 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.61 0.764 . . . . 63.31 111.706 -174.351 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -74.64 -18.74 60.5 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 123.171 0.588 . . . . 65.13 112.162 -177.519 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 87.2 m -66.17 -30.14 70.56 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 122.628 0.371 . . . . 52.55 111.092 166.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -81.91 -24.49 35.64 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.995 0.518 . . . . 72.42 111.868 174.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.1 mptm? -71.83 -73.23 0.19 Allowed 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 121.27 0.557 . . . . 73.43 110.739 169.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.55 HH21 ' HG2' ' A' ' 37' ' ' LYS . 18.2 mtp180 -84.41 -53.99 5.07 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 123.941 0.896 . . . . 74.35 112.032 -171.238 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 131.25 163.35 10.87 Favored Glycine 0 N--CA 1.482 1.763 0 CA-C-O 119.525 -0.597 . . . . 73.04 113.076 -179.476 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -67.52 85.7 0.36 Allowed 'Trans proline' 0 C--N 1.379 2.142 0 C-N-CA 122.888 2.392 . . . . 75.05 111.905 173.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.2 m -141.72 148.55 39.21 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 124.108 0.963 . . . . 54.13 110.051 -176.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 89.9 p -61.76 -31.97 72.2 Favored 'General case' 0 N--CA 1.498 1.945 0 C-N-CA 123.281 0.632 . . . . 64.1 111.478 176.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.55 ' HG2' HH21 ' A' ' 32' ' ' ARG . 88.3 tttt -59.17 -34.45 72.13 Favored 'General case' 0 CA--C 1.561 1.397 0 C-N-CA 125.074 1.349 . . . . 75.33 111.751 173.229 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 87.5 m -79.11 -39.33 33.96 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 124.094 0.958 . . . . 72.33 110.18 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 26.7 m-85 -65.86 -26.89 67.85 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 115.179 -0.919 . . . . 75.23 111.95 175.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.31 -36.88 84.07 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.338 0.655 . . . . 71.42 111.668 173.206 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -66.44 -54.51 23.31 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 123.116 0.566 . . . . 74.01 110.642 172.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 96.1 mt -60.7 -23.06 64.58 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.459 1.104 . . . . 75.42 112.41 178.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.65 -57.5 9.86 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.231 0.612 . . . . 72.5 111.467 174.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -68.52 -27.58 66.24 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-N 115.544 -0.753 . . . . 75.23 112.161 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.443 ' HD3' HD21 ' A' ' 46' ' ' LEU . 0.6 OUTLIER -70.64 -58.18 3.94 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.731 0.813 . . . . 74.35 109.711 179.608 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.548 HD12 ' HZ3' ' A' ' 17' ' ' TRP . 41.4 mt -83.23 -5.35 59.1 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.475 0.71 . . . . 75.42 112.614 -173.402 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.1 t70 72.73 -2.71 2.58 Favored 'General case' 0 N--CA 1.498 1.935 0 C-N-CA 125.006 1.322 . . . . 64.14 112.146 -177.129 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.454 ' HA ' ' HE2' ' A' ' 48' ' ' LYS . 11.5 mmpt? -97.55 137.58 36.27 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.772 0.829 . . . . 73.4 110.058 -177.142 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 36.0 m-80 -52.19 149.44 9.77 Favored Pre-proline 0 N--CA 1.494 1.767 0 C-N-CA 123.49 0.716 . . . . 72.3 112.645 178.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -59.32 -22.12 63.87 Favored 'Trans proline' 0 C--N 1.387 2.601 0 C-N-CA 122.828 2.352 . . . . 73.5 113.082 -176.06 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -68.22 -43.76 77.28 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 124.022 0.929 . . . . 75.34 110.896 172.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 11.4 mm-40 -65.73 -41.88 91.7 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.393 0.677 . . . . 73.44 111.076 178.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 99.2 t -69.36 -43.83 80.73 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 C-N-CA 123.573 0.749 . . . . 64.24 111.807 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 93.5 p -62.67 -39.48 94.06 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.097 0.559 . . . . 74.4 111.029 179.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -72.5 -36.69 68.46 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 115.824 -0.625 . . . . 71.3 112.01 175.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -67.63 -34.97 78.05 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 122.775 0.43 . . . . 74.53 111.398 -179.195 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -53.63 -45.49 70.17 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.808 0.843 . . . . 75.21 110.242 169.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 40.4 mt-30 -74.48 -30.33 61.8 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 114.984 -1.007 . . . . 74.23 112.052 178.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -68.46 -38.62 81.25 Favored 'General case' 0 N--CA 1.497 1.885 0 C-N-CA 123.908 0.883 . . . . 72.1 110.788 178.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.634 HD22 ' HB3' ' A' ' 22' ' ' ASP . 32.7 mt -53.62 -51.77 62.0 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.281 1.032 . . . . 74.51 110.245 168.44 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 45.5 mtt . . . . . 0 CA--C 1.552 1.041 0 N-CA-C 113.335 0.865 . . . . 72.12 113.335 178.406 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . 0.426 ' CD2' ' HG3' ' A' ' 56' ' ' ARG . 95.9 m95 . . . . . 0 N--CA 1.481 1.099 0 CA-C-O 120.938 0.399 . . . . 74.34 110.212 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 72.2 p -131.68 168.1 18.32 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.43 1.092 . . . . 72.11 110.521 -172.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -56.59 -22.9 36.97 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 123.68 0.792 . . . . 73.11 113.113 -178.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.425 ' O ' HG21 ' A' ' 24' ' ' VAL . 10.9 m-80 -71.36 -49.79 38.77 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.54 0.736 . . . . 71.0 110.268 179.615 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.45 -41.76 65.74 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-N 115.675 -0.693 . . . . 74.02 110.101 -176.524 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.464 ' HB3' HD22 ' A' ' 60' ' ' LEU . 2.1 m-20 -51.31 -44.71 62.0 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 124.735 1.214 . . . . 74.54 111.805 172.253 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 60.6 ttp180 -60.61 -45.88 92.37 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.51 0.724 . . . . 74.24 111.554 175.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.425 HG21 ' O ' ' A' ' 20' ' ' ASN . 58.3 t -63.07 -37.0 78.21 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.353 0 C-N-CA 123.567 0.747 . . . . 75.12 111.378 -179.501 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 86.8 mt -64.13 -50.03 78.75 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 C-N-CA 122.813 0.445 . . . . 73.13 110.875 175.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 95.3 mt -59.36 -33.08 70.73 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 123.358 0.663 . . . . 63.34 111.946 176.519 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 45.8 tp -69.35 -58.13 4.4 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.41 0.684 . . . . 74.34 110.883 179.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.573 ' HA ' ' HB3' ' A' ' 31' ' ' LYS . 75.2 mm-40 -68.26 -23.19 64.75 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.576 0.75 . . . . 71.34 112.614 -177.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 54.1 t -68.17 -29.05 67.83 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.208 0.603 . . . . 74.23 111.98 174.246 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -104.02 -15.07 15.7 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 123.2 0.6 . . . . 62.33 112.023 176.488 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.573 ' HB3' ' HA ' ' A' ' 28' ' ' GLU . 43.7 tttm -82.65 -49.52 9.72 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 124.154 0.982 . . . . 64.45 110.805 177.025 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 88.4 mtt180 -99.17 -64.11 1.07 Allowed 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.676 0.79 . . . . 74.11 110.303 171.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 152.39 173.94 22.44 Favored Glycine 0 CA--C 1.539 1.548 0 CA-C-N 115.266 -0.879 . . . . 74.33 111.912 -172.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -86.02 31.46 0.47 Allowed 'Trans proline' 0 CA--C 1.56 1.814 0 C-N-CA 123.002 2.468 . . . . 64.11 113.879 -179.471 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 43.2 t -80.09 161.03 25.56 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 123.358 0.663 . . . . 75.22 112.611 -177.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 78.3 p -65.49 -28.19 69.02 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 124.099 0.96 . . . . 74.41 111.93 176.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -76.65 -18.97 58.28 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.405 0.682 . . . . 75.23 111.743 176.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 56.7 m -82.37 -38.4 24.21 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 109.203 -0.665 . . . . 62.41 109.203 171.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -64.76 -29.26 70.23 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 115.658 -0.701 . . . . 73.34 110.977 173.058 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.43 ' HA ' ' HG3' ' A' ' 50' ' ' PRO . . . -70.97 -34.79 71.76 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.668 0.787 . . . . 72.1 111.548 173.708 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -63.5 -54.96 28.16 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 109.726 -0.472 . . . . 74.32 109.726 171.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.402 ' HA ' ' HB3' ' A' ' 45' ' ' LYS . 52.2 mt -59.78 -24.73 64.33 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 125.271 1.428 . . . . 70.3 112.972 179.074 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.37 -55.47 17.99 Favored 'General case' 0 CA--C 1.552 1.03 0 CA-C-O 121.045 0.45 . . . . 53.12 110.742 172.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.49 -28.43 67.84 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.537 0.735 . . . . 71.04 112.118 177.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.402 ' HB3' ' HA ' ' A' ' 42' ' ' LEU . 23.1 tptm -76.2 -38.43 56.53 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.569 1.148 . . . . 74.11 111.594 -176.09 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 62.6 mt -112.52 11.32 19.74 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.659 0.784 . . . . 74.44 112.443 -173.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 64.37 21.71 12.56 Favored 'General case' 0 N--CA 1.506 2.359 0 C-N-CA 124.762 1.225 . . . . 72.12 112.684 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -109.94 -163.2 0.84 Allowed 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.725 0.81 . . . . 73.53 111.796 -175.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.432 ' HB2' HE21 ' A' ' 52' ' ' GLN . 26.1 m-80 -124.87 147.1 55.39 Favored Pre-proline 0 N--CA 1.487 1.385 0 C-N-CA 123.919 0.888 . . . . 75.21 109.984 178.882 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.43 ' HG3' ' HA ' ' A' ' 40' ' ' ALA . 50.6 Cg_exo -55.25 -27.99 59.72 Favored 'Trans proline' 0 C--N 1.382 2.32 0 C-N-CA 123.547 2.831 . . . . 72.2 115.659 -172.14 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -72.13 -44.81 62.55 Favored 'General case' 0 N--CA 1.494 1.768 0 C-N-CA 123.253 0.621 . . . . 64.21 111.117 176.015 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.432 HE21 ' HB2' ' A' ' 49' ' ' ASN . 43.4 mt-30 -57.46 -41.35 80.39 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 123.887 0.875 . . . . 72.24 111.993 172.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 66.8 t -69.78 -43.07 80.18 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.032 0 CA-C-N 115.76 -0.655 . . . . 74.45 111.291 177.722 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 45.2 t -60.01 -34.84 73.89 Favored 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 123.721 0.808 . . . . 73.24 111.658 177.332 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.19 -51.37 54.37 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 114.906 -1.043 . . . . 74.32 110.145 177.774 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.426 ' HG3' ' CD2' ' A' ' 17' ' ' TRP . 29.0 mmt-85 -65.8 -30.3 70.91 Favored 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 113.039 0.755 . . . . 74.53 113.039 -179.097 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.403 ' O ' ' HG2' ' A' ' 61' ' ' MET . 19.9 t80 -56.3 -52.94 62.66 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 122.738 0.415 . . . . 75.31 110.502 171.605 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 67.8 mt-30 -73.42 -24.93 60.33 Favored 'General case' 0 CA--C 1.554 1.099 0 CA-C-N 115.574 -0.739 . . . . 72.51 112.074 -176.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 21.2 mm-40 -71.27 -43.11 67.82 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.302 0.641 . . . . 72.53 110.166 172.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.464 HD22 ' HB3' ' A' ' 22' ' ' ASP . 25.3 mt -58.64 -45.69 88.74 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 124.31 1.044 . . . . 75.32 111.659 174.687 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' MET . . . . . 0.403 ' HG2' ' O ' ' A' ' 57' ' ' PHE . 35.5 mmt . . . . . 0 N--CA 1.482 1.167 0 C-N-CA 123.129 0.572 . . . . 72.01 111.167 175.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . 0.487 ' HZ2' ' HB3' ' A' ' 52' ' ' GLN . 93.2 m95 . . . . . 0 CA--C 1.56 1.347 0 N-CA-C 110.512 -0.181 . . . . 74.32 110.512 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 80.6 p -119.54 -174.97 2.85 Favored 'General case' 0 N--CA 1.503 2.191 0 C-N-CA 123.746 0.818 . . . . 72.32 111.848 176.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 11.9 ptm180 -77.45 -18.59 57.05 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.243 0.617 . . . . 75.43 112.167 170.242 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -67.27 -36.08 80.84 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 123.499 0.719 . . . . 74.15 112.05 -176.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.38 -39.86 95.66 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 123.08 0.552 . . . . 74.2 111.035 -177.886 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.603 ' HA ' HD11 ' A' ' 60' ' ' LEU . 27.8 m-20 -49.93 -52.0 36.69 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.695 0.798 . . . . 73.34 111.313 175.487 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 42.0 ttt85 -58.77 -48.67 80.42 Favored 'General case' 0 CA--C 1.559 1.306 0 CA-C-N 114.834 -1.075 . . . . 75.01 112.707 176.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 89.0 t -65.52 -44.65 94.0 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 C-N-CA 123.896 0.878 . . . . 75.43 112.314 -175.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 97.3 mt -69.03 -50.24 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.122 0 C-N-CA 123.711 0.804 . . . . 74.21 111.164 -178.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.488 HD12 HD21 ' A' ' 60' ' ' LEU . 95.3 mt -57.79 -27.87 63.5 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 112.421 0.526 . . . . 74.03 112.421 175.616 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.3 tp -74.49 -60.81 2.11 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 122.954 0.502 . . . . 73.42 111.814 177.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.418 ' HB2' HD21 ' A' ' 42' ' ' LEU . 71.2 mm-40 -72.4 -26.35 61.84 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 113.335 0.865 . . . . 74.14 113.335 -172.705 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 71.7 m -67.16 -44.38 79.89 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-O 120.948 0.404 . . . . 74.42 111.7 -178.567 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.6 pt20 -79.25 -32.41 43.77 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 122.618 0.367 . . . . 74.45 111.86 177.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 28.8 ttpp -80.27 -33.38 37.83 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.322 0.649 . . . . 75.34 112.279 -173.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 48.0 mtt180 -102.19 -59.93 1.62 Allowed 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.166 0.586 . . . . 73.53 111.77 179.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 164.15 173.34 32.7 Favored Glycine 0 CA--C 1.536 1.37 0 N-CA-C 114.66 0.624 . . . . 71.45 114.66 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -87.65 3.15 6.41 Favored 'Trans proline' 0 CA--C 1.557 1.65 0 C-N-CA 123.47 2.78 . . . . 64.43 114.147 -177.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 32.3 t -65.07 151.11 46.86 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 123.782 0.833 . . . . 63.25 112.16 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 89.9 p -65.48 -18.38 65.27 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.314 0.646 . . . . 71.22 111.812 176.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.415 ' N ' ' HD2' ' A' ' 37' ' ' LYS . 0.2 OUTLIER -77.83 -15.01 59.38 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.745 0.818 . . . . 71.03 111.936 175.859 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 90.0 m -77.63 -39.55 44.88 Favored 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 108.845 -0.798 . . . . 74.3 108.845 169.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -65.38 -30.25 71.05 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.045 0.938 . . . . 75.13 111.313 172.095 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.72 -35.84 65.15 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.454 0.702 . . . . 71.13 111.584 175.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 56.1 t80 -65.19 -42.39 93.65 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-O 121.47 0.653 . . . . 65.04 110.602 170.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.465 HD22 ' HD3' ' A' ' 45' ' ' LYS . 50.4 mt -64.94 -32.92 74.87 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.842 0.857 . . . . 70.51 111.543 175.638 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.7 -35.56 81.1 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.285 0.634 . . . . 75.25 111.535 174.083 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.71 -45.82 81.29 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.177 0.591 . . . . 75.32 112.07 177.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.465 ' HD3' HD22 ' A' ' 42' ' ' LEU . 18.0 ptmt -86.05 -22.99 26.93 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 112.938 0.718 . . . . 72.23 112.938 -174.282 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 92.3 mt -90.55 -10.66 42.67 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.217 0.607 . . . . 74.32 111.475 171.393 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.3 t70 64.7 36.62 8.09 Favored 'General case' 0 CA--C 1.567 1.608 0 C-N-CA 124.269 1.027 . . . . 74.3 111.525 176.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -133.23 -168.69 2.13 Favored 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 124.005 0.922 . . . . 72.53 111.996 -176.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -85.86 144.98 40.22 Favored Pre-proline 0 N--CA 1.492 1.642 0 C-N-CA 123.335 0.654 . . . . 72.43 111.334 175.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -61.33 -31.0 88.62 Favored 'Trans proline' 0 C--N 1.388 2.609 0 C-N-CA 122.911 2.407 . . . . 73.43 112.847 177.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -65.79 -37.13 85.47 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.062 0.945 . . . . 71.2 110.855 177.335 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.487 ' HB3' ' HZ2' ' A' ' 17' ' ' TRP . 75.2 mm-40 -75.5 -31.23 60.1 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.508 0.723 . . . . 72.22 112.187 179.193 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 94.8 t -63.32 -40.27 88.42 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 C-N-CA 122.827 0.451 . . . . 64.35 110.293 170.069 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 37.9 t -62.67 -39.46 94.01 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.387 0.675 . . . . 52.45 111.809 177.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -53.55 -53.75 47.15 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 121.315 0.579 . . . . 72.31 110.679 174.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 9.7 mmm180 -61.1 -41.69 97.14 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 114.634 -1.166 . . . . 72.5 112.919 -178.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 40.4 t80 -57.91 -51.12 70.94 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 124.029 0.932 . . . . 73.54 112.442 176.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 -74.64 -24.81 58.89 Favored 'General case' 0 CA--C 1.555 1.148 0 CA-C-N 115.775 -0.648 . . . . 74.12 111.744 -176.05 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -75.47 -29.29 59.57 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.09 0.556 . . . . 75.44 110.692 170.068 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.603 HD11 ' HA ' ' A' ' 22' ' ' ASP . 9.8 mt -66.04 -41.75 90.47 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.827 0.851 . . . . 72.14 111.9 175.693 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 25.3 mmt . . . . . 0 N--CA 1.484 1.238 0 CA-C-O 121.198 0.523 . . . . 74.25 111.321 175.996 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 95.6 m95 . . . . . 0 N--CA 1.475 0.81 0 N-CA-C 110.374 -0.232 . . . . 74.34 110.374 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' THR . . . . . 0.496 ' OG1' ' HB2' ' A' ' 21' ' ' ASP . 41.4 p -89.7 148.22 23.41 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 109.081 -0.711 . . . . 74.15 109.081 179.21 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -63.03 -20.09 64.99 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.28 0.632 . . . . 73.0 112.435 -172.44 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.435 ' O ' HG21 ' A' ' 24' ' ' VAL . 9.3 m120 -75.94 -47.09 26.55 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 123.507 0.723 . . . . 75.1 109.908 171.825 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.496 ' HB2' ' OG1' ' A' ' 18' ' ' THR . 0.4 OUTLIER -59.96 -55.79 29.76 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 125.208 1.403 . . . . 74.55 111.783 -173.563 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.534 ' HB2' HD22 ' A' ' 60' ' ' LEU . 1.6 p30 -64.49 -32.51 74.17 Favored 'General case' 0 CA--C 1.557 1.238 0 CA-C-N 115.735 -0.666 . . . . 73.43 112.573 179.786 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -64.58 -38.02 89.57 Favored 'General case' 0 CA--C 1.56 1.335 0 C-N-CA 123.011 0.524 . . . . 74.3 111.395 174.011 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.435 HG21 ' O ' ' A' ' 20' ' ' ASN . 99.1 t -67.69 -32.14 55.48 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 C-N-CA 123.182 0.593 . . . . 74.33 111.239 176.262 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 91.5 mt -56.6 -54.91 23.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 C-N-CA 122.238 0.215 . . . . 71.34 110.907 173.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.493 ' HG ' HD12 ' A' ' 60' ' ' LEU . 98.7 mt -57.8 -44.07 86.08 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 123.394 0.678 . . . . 72.25 111.757 176.184 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 39.5 tp -60.57 -49.46 77.46 Favored 'General case' 0 CA--C 1.561 1.397 0 C-N-CA 124.286 1.034 . . . . 64.41 112.452 -177.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -77.78 -20.35 53.47 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.575 0.75 . . . . 74.5 112.539 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 69.4 m -74.12 -29.27 61.75 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-O 120.846 0.355 . . . . 73.42 110.732 170.33 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 91.7 mt-30 -75.41 -19.58 59.43 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.215 0.606 . . . . 75.33 111.42 170.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 35.8 ttmt -82.88 -69.76 0.6 Allowed 'General case' 0 CA--C 1.559 1.302 0 C-N-CA 123.512 0.725 . . . . 75.23 111.407 173.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 51.6 mtp180 -81.07 -42.14 21.49 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.582 0.753 . . . . 74.43 112.699 -174.377 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 122.74 161.08 11.11 Favored Glycine 0 CA--C 1.54 1.609 0 CA-C-O 119.711 -0.494 . . . . 63.31 112.784 -175.335 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -69.27 92.66 0.47 Allowed 'Trans proline' 0 C--N 1.374 1.901 0 C-N-CA 122.608 2.206 . . . . 73.13 111.914 173.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 43.6 t -148.47 157.74 43.66 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 123.084 0.554 . . . . 73.02 112.287 -174.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 95.4 p -63.63 -29.54 70.77 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 123.569 0.747 . . . . 75.15 111.092 175.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -63.57 -34.88 78.78 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.772 0.829 . . . . 75.44 111.019 175.174 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 21.5 m -82.94 -33.32 26.78 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 115.249 -0.887 . . . . 72.04 110.054 -177.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -68.63 -38.17 80.29 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.372 0.669 . . . . 74.11 111.104 175.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . 0.416 ' HA ' ' HG3' ' A' ' 50' ' ' PRO . . . -69.35 -35.3 75.74 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.378 0.671 . . . . 72.24 111.275 174.252 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -66.43 -47.71 72.33 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 123.522 0.729 . . . . 73.52 111.435 177.08 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 25.9 mt -69.17 -24.22 64.03 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.49 1.116 . . . . 73.54 111.986 176.347 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.51 -47.34 82.11 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-O 121.091 0.472 . . . . 73.32 110.601 170.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -68.09 -39.69 82.81 Favored 'General case' 0 CA--C 1.557 1.213 0 C-N-CA 123.588 0.755 . . . . 71.54 112.058 177.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 32.3 ttmt -73.94 -36.51 64.66 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 124.094 0.958 . . . . 72.52 112.223 -176.568 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 82.6 mt -108.27 9.56 27.94 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 112.882 0.697 . . . . 74.43 112.882 -174.202 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 66.71 11.73 8.38 Favored 'General case' 0 N--CA 1.503 2.194 0 C-N-CA 124.73 1.212 . . . . 64.55 112.944 -179.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm -91.65 -163.99 1.12 Allowed 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 124.068 0.947 . . . . 75.31 112.049 -175.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -124.81 149.75 63.64 Favored Pre-proline 0 CA--C 1.567 1.63 0 C-N-CA 124.087 0.955 . . . . 74.21 109.212 174.464 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.416 ' HG3' ' HA ' ' A' ' 40' ' ' ALA . 84.5 Cg_exo -48.68 -44.22 31.68 Favored 'Trans proline' 0 C--N 1.391 2.769 0 C-N-CA 123.782 2.988 . . . . 74.43 115.755 -173.879 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -68.51 -35.22 77.18 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 122.51 0.324 . . . . 73.43 111.315 -179.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 -62.69 -45.97 90.34 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 123.345 0.658 . . . . 74.2 111.076 175.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 98.8 t -62.2 -40.7 88.6 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.04 0 CA-C-N 115.503 -0.771 . . . . 74.42 111.252 176.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.0 t -68.71 -45.13 72.38 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.902 0.881 . . . . 75.11 112.765 -175.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -64.88 -42.16 95.06 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 122.694 0.398 . . . . 74.31 110.878 178.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 22.3 tpt180 -66.39 -39.34 88.99 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 122.592 0.357 . . . . 74.34 110.785 177.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 34.4 t80 -51.24 -53.13 38.3 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 124.57 1.148 . . . . 73.22 112.371 178.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -73.66 -23.09 59.8 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 112.72 0.637 . . . . 74.34 112.72 -177.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -75.88 -26.0 56.65 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 123.208 0.603 . . . . 74.15 110.783 172.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.534 HD22 ' HB2' ' A' ' 22' ' ' ASP . 42.1 mt -74.6 -40.72 61.41 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.818 0.847 . . . . 75.23 110.98 171.587 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 84.0 mtp . . . . . 0 N--CA 1.479 1.018 0 C-N-CA 123.436 0.694 . . . . 63.02 111.202 176.54 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . 0.442 ' CH2' ' HG3' ' A' ' 48' ' ' LYS . 99.0 m95 . . . . . 0 C--O 1.241 0.609 0 N-CA-C 110.04 -0.356 . . . . 73.24 110.04 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 21.7 p -111.72 164.28 13.21 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 108.551 -0.907 . . . . 70.01 108.551 174.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 27.3 ptt-85 -57.59 -19.84 28.49 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.305 0.642 . . . . 73.15 112.465 178.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.424 ' O ' HG21 ' A' ' 24' ' ' VAL . 28.0 m-80 -70.86 -49.31 47.44 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.45 0.7 . . . . 71.52 110.754 174.556 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -62.24 -57.05 12.86 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.676 0.79 . . . . 71.24 112.272 -176.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.415 ' HB2' HD13 ' A' ' 60' ' ' LEU . 2.2 p30 -64.68 -31.89 73.31 Favored 'General case' 0 CA--C 1.555 1.162 0 C-N-CA 123.335 0.654 . . . . 72.31 112.399 -176.285 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -62.75 -39.24 93.54 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.557 0.743 . . . . 74.4 111.821 174.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.424 HG21 ' O ' ' A' ' 20' ' ' ASN . 62.4 t -65.61 -38.45 82.37 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 C-N-CA 122.969 0.508 . . . . 72.34 110.577 174.437 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 70.5 mt -59.87 -47.16 92.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 CA-C-O 120.96 0.409 . . . . 74.32 110.951 174.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.453 HD12 HD21 ' A' ' 60' ' ' LEU . 88.9 mt -62.86 -36.81 84.5 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.201 1.0 . . . . 72.11 112.09 178.255 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 53.5 tp -67.71 -53.85 24.22 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.339 0.656 . . . . 73.14 111.289 178.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.488 ' HA ' ' HB3' ' A' ' 31' ' ' LYS . 8.2 mm-40 -71.12 -20.78 62.28 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.737 0.815 . . . . 75.11 112.426 -176.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 35.7 t -67.05 -30.97 71.18 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.091 0.557 . . . . 53.45 111.699 171.316 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 24.3 mm-40 -96.86 -23.69 16.24 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.0 0.52 . . . . 74.35 111.501 177.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.488 ' HB3' ' HA ' ' A' ' 28' ' ' GLU . 58.6 tptt -76.17 -58.01 3.53 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.896 0.879 . . . . 74.24 110.649 179.37 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -90.82 -60.27 1.96 Allowed 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.641 0.777 . . . . 74.24 109.818 176.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 148.15 178.94 23.72 Favored Glycine 0 CA--C 1.536 1.375 0 CA-C-N 115.11 -0.95 . . . . 75.21 112.285 -175.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -82.83 35.77 0.59 Allowed 'Trans proline' 0 CA--C 1.562 1.906 0 C-N-CA 123.21 2.606 . . . . 73.41 112.762 174.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 30.3 t -72.36 145.54 47.68 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.959 0.904 . . . . 62.31 111.455 -179.342 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 80.2 p -61.3 -31.93 71.77 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.317 0.647 . . . . 74.5 111.311 173.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.1 tmtm? -65.34 -33.68 76.55 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 124.406 1.082 . . . . 75.43 110.889 174.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 56.2 m -75.04 -38.99 61.27 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.344 0.658 . . . . 64.13 109.786 -179.116 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 28.1 m-85 -67.26 -32.48 73.53 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 123.527 0.731 . . . . 75.42 112.066 174.46 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.14 -34.68 66.23 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.598 0.759 . . . . 64.55 111.324 174.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -63.0 -48.81 77.22 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 123.587 0.755 . . . . 74.23 110.536 172.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.424 ' HB2' HG12 ' A' ' 53' ' ' VAL . 44.4 mt -64.94 -29.31 70.24 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 124.644 1.178 . . . . 75.03 112.226 177.415 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.76 -50.53 68.69 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.13 0.572 . . . . 55.52 110.993 171.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.1 -27.6 62.75 Favored 'General case' 0 CA--C 1.558 1.282 0 C-N-CA 123.16 0.584 . . . . 72.1 112.368 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.53 -51.76 11.08 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.809 0.844 . . . . 73.45 109.959 -178.593 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 63.5 mt -87.1 2.53 49.46 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.872 0.869 . . . . 64.43 111.897 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 62.29 24.02 14.26 Favored 'General case' 0 N--CA 1.497 1.913 0 C-N-CA 124.67 1.188 . . . . 71.31 113.035 178.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.442 ' HG3' ' CH2' ' A' ' 17' ' ' TRP . 72.2 mmtt -96.94 -167.62 1.58 Allowed 'General case' 0 CA--C 1.558 1.252 0 C-N-CA 124.948 1.299 . . . . 73.43 111.144 177.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 24.8 m-80 -105.81 144.55 29.12 Favored Pre-proline 0 N--CA 1.492 1.631 0 C-N-CA 123.683 0.793 . . . . 75.23 110.376 175.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -63.32 -29.8 72.9 Favored 'Trans proline' 0 C--N 1.384 2.417 0 C-N-CA 122.794 2.329 . . . . 73.45 113.037 -175.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -61.12 -49.69 76.23 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.014 0.926 . . . . 73.21 110.334 174.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.464 ' O ' ' HG2' ' A' ' 56' ' ' ARG . 76.3 mt-30 -55.4 -55.64 29.36 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 115.391 -0.822 . . . . 75.44 111.492 176.719 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.424 HG12 ' HB2' ' A' ' 42' ' ' LEU . 84.6 t -55.98 -45.79 80.3 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.305 0 C-N-CA 124.036 0.934 . . . . 73.34 112.468 -174.35 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 32.8 t -61.39 -43.84 98.18 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.377 0.671 . . . . 64.11 111.698 178.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -65.89 -44.93 83.8 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.352 0.661 . . . . 73.44 111.801 178.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.464 ' HG2' ' O ' ' A' ' 52' ' ' GLN . 2.4 mmp_? -65.71 -35.82 81.85 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 122.492 0.317 . . . . 75.11 111.094 -176.35 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.517 ' HA ' HD12 ' A' ' 60' ' ' LEU . 17.0 t80 -53.77 -49.86 67.3 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.959 0.904 . . . . 75.14 111.708 172.241 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -71.8 -25.0 61.82 Favored 'General case' 0 CA--C 1.552 1.034 0 CA-C-N 115.506 -0.77 . . . . 74.3 111.64 -176.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -76.29 -39.4 54.31 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.033 0.533 . . . . 71.14 110.527 173.017 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.517 HD12 ' HA ' ' A' ' 57' ' ' PHE . 16.3 mt -54.26 -46.34 72.61 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 124.712 1.205 . . . . 74.21 111.563 177.27 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 31.7 mmt . . . . . 0 N--CA 1.485 1.293 0 C-N-CA 123.77 0.828 . . . . 75.2 111.498 175.946 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . 0.462 ' HZ2' ' HB3' ' A' ' 52' ' ' GLN . 96.7 m95 . . . . . 0 N--CA 1.484 1.257 0 N-CA-C 111.407 0.151 . . . . 75.45 111.407 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 25.9 p -103.17 164.6 11.52 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 120.979 0.419 . . . . 75.5 111.111 177.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.43 ' HA ' ' HE ' ' A' ' 19' ' ' ARG . 0.4 OUTLIER -60.34 -21.89 62.6 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.965 0.906 . . . . 75.2 112.377 -177.715 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -74.97 -49.51 19.76 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 123.739 0.816 . . . . 74.24 110.902 176.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 59.9 m-20 -59.82 -53.32 59.32 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 123.471 0.708 . . . . 71.22 112.092 -175.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.573 ' HB2' HD22 ' A' ' 60' ' ' LEU . 2.9 p30 -62.66 -32.42 73.47 Favored 'General case' 0 CA--C 1.561 1.372 0 CA-C-N 115.371 -0.832 . . . . 62.42 112.216 -177.579 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 35.7 ttm180 -70.54 -40.39 73.44 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.764 0.825 . . . . 73.04 111.57 176.758 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 45.8 t -61.81 -39.6 84.01 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.344 0 C-N-CA 123.665 0.786 . . . . 74.41 111.22 175.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 90.8 mt -56.24 -53.96 33.41 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 C-N-CA 123.206 0.602 . . . . 72.31 111.219 174.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 96.5 mt -62.49 -46.85 86.57 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.267 0.627 . . . . 75.15 112.18 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 49.1 tp -61.89 -50.3 72.75 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.973 0.909 . . . . 73.43 112.145 -174.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.509 ' HB2' HD22 ' A' ' 42' ' ' LEU . 31.1 mt-10 -76.85 -18.27 58.47 Favored 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 112.757 0.651 . . . . 75.32 112.757 -179.01 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 61.9 m -70.02 -29.43 66.48 Favored 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 122.508 0.323 . . . . 74.13 111.108 165.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 -83.7 -20.58 33.25 Favored 'General case' 0 N--CA 1.492 1.626 0 C-N-CA 122.901 0.481 . . . . 74.45 111.984 174.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -74.05 -44.72 53.28 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 122.996 0.519 . . . . 73.21 110.422 171.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 73.9 mtp180 -108.83 -70.98 0.78 Allowed 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.641 0.776 . . . . 75.3 111.954 -173.202 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 155.62 147.57 4.76 Favored Glycine 0 CA--C 1.54 1.617 0 CA-C-O 119.059 -0.856 . . . . 71.24 112.197 -175.292 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -65.67 86.2 0.22 Allowed 'Trans proline' 0 C--N 1.378 2.116 0 C-N-CA 123.234 2.623 . . . . 71.25 112.622 175.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 29.3 t -130.26 155.36 46.42 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 124.023 0.929 . . . . 64.41 110.818 -177.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 81.9 p -66.89 -29.41 69.3 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.259 0.623 . . . . 65.5 111.671 176.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -68.26 -32.06 71.97 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.148 0.579 . . . . 72.54 110.849 172.258 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 66.8 m -79.79 -33.51 40.47 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.218 0.607 . . . . 71.22 109.604 -179.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -69.43 -32.77 71.94 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.396 0.678 . . . . 73.51 111.048 173.195 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.8 -35.2 72.43 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.533 0.733 . . . . 75.12 111.287 173.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -62.93 -50.57 70.3 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.478 0.711 . . . . 73.11 111.121 172.075 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.509 HD22 ' HB2' ' A' ' 28' ' ' GLU . 54.8 mt -66.44 -23.38 66.28 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 124.411 1.085 . . . . 72.23 111.894 178.697 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.12 -45.99 82.83 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.15 0.58 . . . . 72.15 111.166 169.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.1 -32.56 65.05 Favored 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 123.347 0.659 . . . . 75.54 111.953 176.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.432 ' HB3' ' HA ' ' A' ' 42' ' ' LEU . 23.8 tptp -76.92 -34.24 57.69 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.906 1.282 . . . . 73.34 111.677 -173.917 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 92.2 mt -102.82 -5.24 23.84 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 123.73 0.812 . . . . 75.3 112.14 175.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.3 t70 65.2 31.53 10.72 Favored 'General case' 0 CA--C 1.574 1.883 0 C-N-CA 124.583 1.153 . . . . 70.4 111.215 -178.162 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -110.03 -177.2 3.19 Favored 'General case' 0 N--CA 1.495 1.812 0 C-N-CA 124.53 1.132 . . . . 75.32 111.984 -178.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -85.98 140.98 35.13 Favored Pre-proline 0 N--CA 1.489 1.489 0 C-N-CA 123.293 0.637 . . . . 72.41 110.853 173.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -66.63 -24.68 47.84 Favored 'Trans proline' 0 C--N 1.38 2.222 0 C-N-CA 122.4 2.067 . . . . 72.11 113.039 -177.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -67.34 -47.05 71.64 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.522 0.729 . . . . 64.03 110.186 173.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.462 ' HB3' ' HZ2' ' A' ' 17' ' ' TRP . 84.2 mm-40 -60.62 -32.5 71.64 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.695 0.798 . . . . 64.5 112.081 177.112 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.461 HG11 ' HB2' ' A' ' 42' ' ' LEU . 88.8 t -74.95 -45.12 43.9 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.224 0 C-N-CA 123.859 0.864 . . . . 75.0 111.681 177.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 87.4 p -63.91 -42.51 97.38 Favored 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 123.1 0.56 . . . . 74.23 111.318 -179.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -60.61 -41.29 94.47 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.714 0.805 . . . . 73.5 111.432 172.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 1.2 tpp180 -64.16 -42.86 96.56 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 122.985 0.514 . . . . 74.33 111.736 -174.023 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -51.38 -48.65 62.48 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 124.002 0.921 . . . . 73.44 111.626 173.271 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -73.27 -32.52 64.71 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-N 115.551 -0.75 . . . . 75.24 112.301 -174.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 17.6 mm-40 -70.94 -41.76 70.71 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.296 0.638 . . . . 74.21 110.479 175.24 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.573 HD22 ' HB2' ' A' ' 22' ' ' ASP . 7.5 mt -53.11 -44.11 67.38 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 124.908 1.283 . . . . 74.14 112.787 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 31.6 mmt . . . . . 0 CA--C 1.558 1.288 0 O-C-N 123.962 0.789 . . . . 74.53 111.11 177.075 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 85.1 m95 . . . . . 0 N--CA 1.478 0.959 0 N-CA-C 109.869 -0.419 . . . . 74.12 109.869 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 24.8 p -98.47 156.61 16.69 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 109.293 -0.632 . . . . 74.34 109.293 176.06 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 6.3 ptm180 -58.47 -21.16 50.6 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 113.869 1.062 . . . . 74.33 113.869 -173.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.421 ' O ' HG21 ' A' ' 24' ' ' VAL . 3.6 t-20 -74.32 -49.16 24.1 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 122.784 0.433 . . . . 73.13 110.403 176.582 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.6 -58.09 9.57 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.24 1.016 . . . . 74.23 113.287 -177.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.544 ' HB2' HD12 ' A' ' 60' ' ' LEU . 3.0 p30 -63.36 -31.73 72.97 Favored 'General case' 0 CA--C 1.56 1.342 0 C-N-CA 122.748 0.419 . . . . 63.23 111.914 -177.752 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 42.7 ttt-85 -64.97 -35.48 81.32 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 123.261 0.624 . . . . 74.53 111.541 174.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.421 HG21 ' O ' ' A' ' 20' ' ' ASN . 90.2 t -70.77 -33.77 53.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 C-N-CA 123.276 0.631 . . . . 61.45 111.017 174.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 95.0 mt -57.93 -46.99 87.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 CA-C-O 120.707 0.289 . . . . 71.5 110.419 172.503 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.622 HD22 ' HB3' ' A' ' 60' ' ' LEU . 96.1 mt -60.77 -38.5 85.48 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.845 0.858 . . . . 74.12 112.313 176.392 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 40.4 tp -68.9 -47.44 65.8 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.462 0.705 . . . . 74.22 111.733 -179.434 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -75.69 -23.59 56.19 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.301 0.64 . . . . 74.24 111.913 -179.19 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . 0.456 ' SG ' ' HE1' ' A' ' 57' ' ' PHE . 34.7 t -64.76 -31.03 72.07 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.417 0.687 . . . . 74.24 111.284 171.816 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -88.58 -31.53 18.57 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.467 0.707 . . . . 73.11 111.648 176.222 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -78.63 -70.17 0.51 Allowed 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.0 0.52 . . . . 74.2 111.105 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 7.2 mpt_? -70.46 -28.62 65.15 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.688 0.795 . . . . 73.41 112.102 178.569 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.16 167.8 35.87 Favored Glycine 0 CA--C 1.536 1.348 0 CA-C-O 119.493 -0.615 . . . . 74.53 112.579 -175.491 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_exo -72.62 87.72 0.94 Allowed 'Trans proline' 0 C--N 1.373 1.841 0 C-N-CA 122.606 2.204 . . . . 65.54 111.956 175.022 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.8 t -135.56 158.36 44.59 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.356 0.662 . . . . 73.12 111.515 -177.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 64.4 p -63.65 -38.66 91.96 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.701 0.8 . . . . 74.14 111.863 177.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 57.8 pttt -73.55 -11.15 60.35 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 123.283 0.633 . . . . 73.0 112.382 177.253 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 56.6 m -78.36 -40.38 36.52 Favored 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 108.97 -0.752 . . . . 74.01 108.97 174.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 49.1 m-85 -65.91 -33.37 75.67 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.673 0.789 . . . . 73.13 111.145 173.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.82 -41.46 83.04 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.361 0.664 . . . . 62.13 111.39 174.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -62.07 -50.4 72.1 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 122.883 0.473 . . . . 75.02 110.59 173.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 59.4 mt -63.33 -23.71 67.54 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 124.84 1.256 . . . . 72.23 112.7 178.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . 0.551 ' HA ' ' O ' ' A' ' 48' ' ' LYS . . . -65.59 -50.85 63.6 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.135 0.574 . . . . 73.15 111.45 173.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.79 -28.26 61.56 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-N 115.907 -0.588 . . . . 53.53 111.956 176.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -71.19 -47.38 57.84 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 124.403 1.081 . . . . 75.31 111.585 -176.46 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 75.7 mt -107.34 -0.22 22.6 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.754 0.822 . . . . 71.02 112.701 -172.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 62.0 33.57 17.2 Favored 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 124.571 1.148 . . . . 73.33 112.074 -176.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.551 ' O ' ' HA ' ' A' ' 43' ' ' ALA . 45.6 mmtm -126.48 116.22 20.78 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.811 0.845 . . . . 73.14 109.573 -178.878 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -48.3 148.43 3.26 Favored Pre-proline 0 N--CA 1.502 2.14 0 C-N-CA 123.691 0.797 . . . . 73.32 112.954 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -53.82 -31.67 63.07 Favored 'Trans proline' 0 C--N 1.387 2.557 0 C-N-CA 123.285 2.657 . . . . 74.51 115.041 -168.224 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 25.3 m-80 -63.62 -38.87 92.74 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 123.154 0.582 . . . . 75.32 111.511 178.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -62.41 -43.09 99.65 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.971 0.908 . . . . 75.31 110.229 178.21 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 57.6 t -68.81 -42.68 82.86 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.982 0 CA-C-N 114.261 -1.336 . . . . 75.33 111.716 -177.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 58.0 m -64.19 -36.36 83.79 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.996 0.918 . . . . 63.4 112.789 -177.05 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -63.58 -46.8 84.19 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 122.797 0.439 . . . . 75.31 111.084 175.063 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 17.2 mmt180 -70.67 -27.76 64.27 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 112.708 0.632 . . . . 75.32 112.708 178.227 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.456 ' HE1' ' SG ' ' A' ' 29' ' ' CYS . 22.8 t80 -56.38 -55.52 32.49 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.078 0.551 . . . . 74.53 110.735 175.162 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -71.69 -25.99 62.32 Favored 'General case' 0 CA--C 1.554 1.111 0 CA-C-N 115.232 -0.895 . . . . 73.4 111.637 -178.502 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -72.39 -38.87 68.36 Favored 'General case' 0 CA--C 1.556 1.19 0 C-N-CA 124.818 1.247 . . . . 74.32 109.684 179.198 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.622 ' HB3' HD22 ' A' ' 26' ' ' LEU . 44.3 mt -73.98 -37.43 64.48 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.758 1.223 . . . . 72.03 111.716 177.612 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' MET . . . . . 0.437 ' HA ' ' HE2' ' A' ' 61' ' ' MET . 29.4 mmt . . . . . 0 N--CA 1.487 1.398 0 C-N-CA 122.909 0.484 . . . . 65.34 111.436 174.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 90.3 m95 . . . . . 0 CA--C 1.542 0.651 0 N-CA-C 109.907 -0.405 . . . . 74.34 109.907 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 37.7 p -103.53 167.37 9.85 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.262 0.625 . . . . 62.41 111.597 -175.22 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.435 ' O ' ' HB2' ' A' ' 23' ' ' ARG . 16.5 ptm180 -62.28 -21.49 65.26 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-N 115.268 -0.878 . . . . 75.11 112.303 174.575 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -77.66 -45.21 25.67 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 123.721 0.808 . . . . 72.15 110.842 174.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.471 ' HA ' HD21 ' A' ' 46' ' ' LEU . 76.7 m-20 -60.26 -58.84 6.8 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.051 0.54 . . . . 62.24 112.079 -176.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -66.87 -30.73 70.97 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 123.498 0.719 . . . . 75.33 111.704 -172.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.435 ' HB2' ' O ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -60.77 -49.61 76.82 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.993 0.917 . . . . 75.23 111.448 175.814 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 89.2 t -69.95 -32.18 50.62 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 CA-C-N 114.587 -1.188 . . . . 74.41 110.889 -179.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 66.4 mt -56.3 -56.28 14.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 C-N-CA 122.491 0.317 . . . . 64.14 110.7 172.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 96.0 mt -58.08 -45.4 87.22 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.317 0.647 . . . . 75.44 112.472 179.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 32.2 tp -64.92 -50.05 67.99 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.094 0.557 . . . . 74.25 112.274 -174.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -78.41 -23.26 46.81 Favored 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 123.033 0.533 . . . . 74.52 112.42 -178.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . 0.525 ' SG ' ' HA ' ' A' ' 34' ' ' PRO . 53.3 t -73.04 -31.46 64.45 Favored 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 122.933 0.493 . . . . 73.11 111.549 177.26 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -87.08 7.4 28.04 Favored 'General case' 0 N--CA 1.486 1.363 0 CA-C-O 120.668 0.27 . . . . 75.31 111.259 173.537 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.628 ' HB2' ' HZ2' ' A' ' 31' ' ' LYS . 4.8 ttmp? -110.03 -53.27 2.69 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 123.871 0.868 . . . . 74.12 111.233 -178.424 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -100.86 9.14 42.7 Favored 'General case' 0 N--CA 1.497 1.889 0 C-N-CA 123.583 0.753 . . . . 73.43 112.22 177.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 87.88 160.39 35.62 Favored Glycine 0 CA--C 1.544 1.881 0 CA-C-O 119.944 -0.365 . . . . 74.34 113.75 -178.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.525 ' HA ' ' SG ' ' A' ' 29' ' ' CYS . 53.2 Cg_endo -84.9 40.51 0.84 Allowed 'Trans proline' 0 C--N 1.37 1.687 0 C-N-CA 123.247 2.631 . . . . 63.3 113.691 -177.743 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 47.4 m -107.43 171.64 7.27 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 123.614 0.765 . . . . 70.31 112.384 -175.03 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 88.7 p -61.58 -24.27 66.55 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 123.789 0.835 . . . . 75.4 112.776 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -49.66 -45.27 48.41 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 124.471 1.108 . . . . 74.44 111.68 170.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.473 HG23 ' HA ' ' A' ' 29' ' ' CYS . 17.7 m -88.35 -33.97 17.77 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 114.806 -1.088 . . . . 74.35 110.9 -173.758 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 -67.79 -35.48 78.74 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.004 0.521 . . . . 75.25 112.251 -179.813 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.2 -36.43 69.19 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.387 0.613 . . . . 42.24 111.411 174.37 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 20.9 t80 -59.69 -49.43 77.77 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 124.236 1.014 . . . . 74.11 111.463 172.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.452 ' HB2' HG12 ' A' ' 53' ' ' VAL . 59.8 mt -70.52 -26.28 63.51 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 124.308 1.043 . . . . 74.41 112.008 178.698 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.1 -56.32 22.27 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 122.892 0.477 . . . . 75.2 111.327 174.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.57 -28.64 68.69 Favored 'General case' 0 N--CA 1.485 1.296 0 N-CA-C 112.363 0.505 . . . . 62.53 112.363 178.143 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.5 tptp -69.96 -45.79 66.65 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.114 0.565 . . . . 75.14 112.104 178.209 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.529 ' HB2' ' HG2' ' A' ' 48' ' ' LYS . 28.8 mt -99.09 0.94 44.67 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.26 0.624 . . . . 75.11 112.153 -173.605 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 25.8 t70 69.45 26.98 5.06 Favored 'General case' 0 CA--C 1.569 1.709 0 C-N-CA 125.115 1.366 . . . . 74.35 111.831 -178.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.529 ' HG2' ' HB2' ' A' ' 46' ' ' LEU . 63.2 mmtt -101.8 -174.89 2.7 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 123.682 0.793 . . . . 64.41 111.458 179.258 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . 0.417 ' N ' HD21 ' A' ' 49' ' ' ASN . 0.8 OUTLIER -100.13 151.35 37.49 Favored Pre-proline 0 N--CA 1.49 1.557 0 C-N-CA 123.821 0.848 . . . . 71.22 109.285 167.909 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -61.83 -33.53 84.58 Favored 'Trans proline' 0 C--N 1.382 2.306 0 C-N-CA 122.721 2.281 . . . . 74.05 113.35 -176.102 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 -65.99 -39.19 90.1 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.666 0.786 . . . . 70.33 111.538 177.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -69.42 -38.72 78.02 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.489 0.716 . . . . 74.4 111.339 -179.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.452 HG12 ' HB2' ' A' ' 42' ' ' LEU . 95.0 t -65.42 -41.42 91.07 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 C-N-CA 123.436 0.694 . . . . 74.12 110.872 174.382 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.8 t -60.05 -42.33 94.23 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.563 0.745 . . . . 71.24 111.311 176.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -64.81 -49.6 70.01 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 115.837 -0.619 . . . . 75.22 111.547 175.024 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.466 ' O ' ' HB2' ' A' ' 60' ' ' LEU . 3.3 tpm_? -57.21 -41.98 80.43 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 122.998 0.519 . . . . 74.22 111.912 -178.002 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -59.07 -54.92 41.58 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.983 0.913 . . . . 74.12 112.24 177.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -73.35 -28.9 62.3 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.012 0.525 . . . . 74.45 111.95 -173.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 56.5 mt-30 -64.72 -46.14 83.55 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 122.947 0.499 . . . . 75.34 110.003 167.011 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.466 ' HB2' ' O ' ' A' ' 56' ' ' ARG . 0.8 OUTLIER -60.38 -38.35 83.66 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 124.256 1.022 . . . . 71.33 111.238 -177.6 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' MET . . . . . 0.543 ' HA ' ' HE1' ' A' ' 61' ' ' MET . 21.7 mmt . . . . . 0 N--CA 1.481 1.107 0 C-N-CA 123.276 0.631 . . . . 65.21 111.869 176.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . 0.522 ' HE1' ' HG3' ' A' ' 56' ' ' ARG . 98.6 m95 . . . . . 0 N--CA 1.482 1.167 0 CA-C-O 120.835 0.35 . . . . 75.12 110.434 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 14.0 p -103.8 160.91 14.38 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 108.382 -0.97 . . . . 62.14 108.382 164.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 36.7 ptt-85 -57.0 -26.05 59.58 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 123.309 0.644 . . . . 73.31 111.886 177.352 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.415 ' O ' HG22 ' A' ' 24' ' ' VAL . 22.3 m-80 -75.52 -37.25 60.21 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.016 0.927 . . . . 75.45 110.911 -179.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -68.37 -47.71 66.68 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 112.961 0.726 . . . . 73.45 112.961 -177.487 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -65.54 -30.36 71.1 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 120.872 0.368 . . . . 72.03 111.38 176.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -62.32 -44.29 96.84 Favored 'General case' 0 N--CA 1.484 1.226 0 CA-C-N 116.421 -0.354 . . . . 73.04 111.053 168.717 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.415 HG22 ' O ' ' A' ' 20' ' ' ASN . 68.1 t -63.17 -34.28 65.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 C-N-CA 123.351 0.66 . . . . 74.03 111.169 176.676 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 88.0 mt -61.32 -44.03 97.7 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.502 0 C-N-CA 122.581 0.353 . . . . 72.23 111.222 173.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.444 ' HG ' HD12 ' A' ' 60' ' ' LEU . 94.0 mt -72.19 -28.53 63.26 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.609 0.764 . . . . 72.21 112.537 174.644 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 47.5 tp -68.01 -52.01 40.53 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 124.211 1.004 . . . . 73.34 110.325 178.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -76.97 -16.21 59.41 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 114.922 -1.035 . . . . 64.43 112.018 178.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 46.1 t -60.61 -32.85 71.97 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 123.076 0.55 . . . . 74.43 111.842 167.131 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 9.6 mm100 -91.14 -18.21 24.86 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 122.686 0.394 . . . . 75.01 110.973 176.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 54.1 tptt -74.67 -34.15 62.62 Favored 'General case' 0 CA--C 1.559 1.307 0 C-N-CA 124.09 0.956 . . . . 74.01 110.801 174.15 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -126.14 -73.77 0.62 Allowed 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.81 0.844 . . . . 74.13 110.561 174.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 150.37 167.33 14.31 Favored Glycine 0 N--CA 1.479 1.566 0 CA-C-O 119.056 -0.858 . . . . 72.35 111.574 -172.062 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.27 74.89 2.46 Favored 'Trans proline' 0 CA--C 1.564 1.991 0 CA-C-N 120.49 2.145 . . . . 72.41 112.363 173.138 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 42.5 t -123.38 164.18 19.36 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 124.302 1.041 . . . . 74.52 111.671 -173.211 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 79.8 p -62.94 -40.62 98.22 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 124.391 1.076 . . . . 64.25 111.621 179.531 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -66.25 -25.76 67.04 Favored 'General case' 0 N--CA 1.485 1.315 0 CA-C-N 115.541 -0.754 . . . . 75.11 112.072 176.075 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 20.8 m -83.87 -32.24 25.3 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.388 0.675 . . . . 74.52 110.394 -177.092 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -61.23 -40.22 93.2 Favored 'General case' 0 CA--C 1.555 1.156 0 C-N-CA 122.84 0.456 . . . . 74.22 110.304 170.374 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.71 -34.72 62.66 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.04 0.936 . . . . 73.3 111.957 177.479 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -64.84 -46.26 82.65 Favored 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 124.19 0.996 . . . . 73.54 110.989 177.19 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.444 ' HB2' HG12 ' A' ' 53' ' ' VAL . 42.7 mt -73.61 -25.61 60.41 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.417 1.087 . . . . 72.21 112.259 175.42 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.91 -42.64 94.56 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-O 120.872 0.368 . . . . 72.12 110.576 171.027 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -71.07 -36.93 72.45 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.682 0.793 . . . . 72.43 112.133 176.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 9.0 tmtm? -77.1 -41.62 41.37 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.908 0.883 . . . . 70.12 111.583 -174.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.441 ' HB3' ' HZ3' ' A' ' 17' ' ' TRP . 83.8 mt -99.6 -1.6 37.74 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.482 0.713 . . . . 71.21 112.02 -176.328 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 36.7 t70 55.58 65.2 1.53 Allowed 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 124.868 1.267 . . . . 73.42 112.815 179.43 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.43 ' HG3' ' CH2' ' A' ' 17' ' ' TRP . 68.1 mmtt -141.48 175.86 9.34 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 124.864 1.265 . . . . 74.03 109.922 172.643 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 65.2 m-80 -75.23 149.59 84.72 Favored Pre-proline 0 CA--C 1.559 1.291 0 N-CA-C 110.158 -0.312 . . . . 74.11 110.158 168.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -54.86 -29.66 64.39 Favored 'Trans proline' 0 C--N 1.387 2.571 0 C-N-CA 122.998 2.465 . . . . 65.11 114.482 -178.256 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -65.16 -41.02 95.08 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 123.612 0.765 . . . . 74.22 111.561 176.539 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 76.7 mm-40 -64.89 -36.79 85.51 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.427 0.691 . . . . 75.43 111.179 -176.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . 0.444 HG12 ' HB2' ' A' ' 42' ' ' LEU . 82.4 t -72.51 -50.78 32.51 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.951 0 CA-C-N 115.161 -0.927 . . . . 73.13 111.045 172.391 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 46.6 t -60.16 -49.47 77.49 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 124.388 1.075 . . . . 74.41 112.884 -169.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.449 ' O ' ' HG2' ' A' ' 59' ' ' GLN . 31.4 mm-40 -56.51 -47.71 78.76 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.412 0.685 . . . . 64.13 111.833 177.703 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.522 ' HG3' ' HE1' ' A' ' 17' ' ' TRP . 10.1 mmm180 -71.91 -28.15 63.29 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.731 0.812 . . . . 74.2 112.843 -179.125 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -66.87 -41.29 87.51 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 108.716 -0.846 . . . . 65.55 108.716 173.302 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -69.33 -29.65 67.53 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 115.356 -0.838 . . . . 72.24 111.642 175.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . 0.449 ' HG2' ' O ' ' A' ' 55' ' ' GLU . 13.3 mm100 -66.99 -41.58 86.5 Favored 'General case' 0 N--CA 1.49 1.57 0 CA-C-O 121.203 0.525 . . . . 73.53 109.832 176.071 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.444 HD12 ' HG ' ' A' ' 26' ' ' LEU . 69.2 mt -59.57 -43.76 93.5 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 114.989 -1.005 . . . . 74.44 111.059 174.225 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 23.6 mmt . . . . . 0 N--CA 1.49 1.529 0 C-N-CA 123.266 0.626 . . . . 73.53 112.325 176.828 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 80.8 m95 . . . . . 0 N--CA 1.48 1.03 0 CA-C-O 121.093 0.473 . . . . 74.23 111.434 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 58.2 p -107.58 166.11 10.92 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.333 0.653 . . . . 71.2 110.949 177.282 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 17.1 ptp180 -57.91 -21.16 42.09 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 124.198 0.999 . . . . 72.11 112.276 174.015 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -76.58 -46.04 27.86 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 124.084 0.954 . . . . 73.14 110.724 174.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 39.2 m-20 -59.7 -57.03 14.67 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.25 0.62 . . . . 75.22 111.735 178.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.567 ' HB2' HD22 ' A' ' 60' ' ' LEU . 2.6 p30 -64.97 -31.74 73.13 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 113.209 0.818 . . . . 73.3 113.209 -174.916 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 48.2 ttt180 -62.28 -42.11 99.06 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 122.893 0.477 . . . . 73.52 111.018 175.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.464 ' HB ' HD22 ' A' ' 46' ' ' LEU . 92.7 t -71.36 -33.09 48.95 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 C-N-CA 123.455 0.702 . . . . 73.34 111.487 177.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 94.5 mt -57.65 -57.38 10.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 CA-C-O 120.886 0.374 . . . . 64.31 110.278 172.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.448 ' HG ' HD12 ' A' ' 60' ' ' LEU . 90.6 mt -61.89 -33.28 73.94 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 115.636 -0.711 . . . . 71.21 112.174 178.656 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 56.0 tp -61.76 -54.46 42.08 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.803 0.841 . . . . 75.1 111.533 179.047 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.497 ' HA ' ' HB3' ' A' ' 31' ' ' LYS . 59.3 mm-40 -75.13 -22.94 57.85 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 113.045 0.757 . . . . 75.23 113.045 -178.679 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 89.6 m -69.83 -30.13 67.56 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 122.775 0.43 . . . . 72.14 111.307 171.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -91.92 -20.38 21.47 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.346 0.658 . . . . 71.25 111.882 173.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.497 ' HB3' ' HA ' ' A' ' 28' ' ' GLU . 58.8 tptt -80.66 -67.21 0.79 Allowed 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.641 0.777 . . . . 73.1 110.545 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 45.2 mtt85 -92.51 -40.38 10.85 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.03 0.932 . . . . 72.03 111.74 -178.34 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 138.48 163.07 9.43 Favored Glycine 0 N--CA 1.481 1.658 0 CA-C-O 119.528 -0.596 . . . . 73.22 112.556 -178.384 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -83.2 36.37 0.61 Allowed 'Trans proline' 0 CA--C 1.561 1.858 0 C-N-CA 123.017 2.478 . . . . 71.04 113.815 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 79.1 p -80.59 161.44 24.73 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.589 0.756 . . . . 75.24 111.732 -177.745 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 99.0 p -67.05 -23.77 65.91 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.04 0.536 . . . . 74.53 111.587 174.745 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -69.8 -32.04 70.28 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.531 0.732 . . . . 65.13 111.492 173.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 86.3 m -78.04 -37.17 47.45 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.048 0.539 . . . . 72.31 109.636 178.228 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -64.7 -32.08 73.59 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.405 0.682 . . . . 73.42 111.39 172.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.62 -39.51 88.36 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 123.415 0.686 . . . . 74.33 111.26 173.527 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -63.05 -49.16 75.67 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.264 0.625 . . . . 73.22 110.797 172.087 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 77.9 mt -63.62 -23.76 67.52 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 124.79 1.236 . . . . 73.54 113.032 -179.652 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.75 -55.03 34.52 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 123.088 0.555 . . . . 70.11 110.998 170.295 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.67 -27.83 62.34 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.586 0.754 . . . . 72.32 112.351 179.223 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -75.91 -39.02 57.1 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.184 0.993 . . . . 75.01 111.325 -177.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.464 HD22 ' HB ' ' A' ' 24' ' ' VAL . 91.0 mt -106.26 12.75 29.66 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.759 0.824 . . . . 74.02 112.687 -177.312 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.0 p30 51.37 23.95 1.95 Allowed 'General case' 0 N--CA 1.501 2.117 0 C-N-CA 125.548 1.539 . . . . 75.43 114.09 -174.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -106.82 -175.01 2.67 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 123.615 0.766 . . . . 71.42 111.565 -178.221 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 47.5 m-80 -96.55 143.84 26.82 Favored Pre-proline 0 N--CA 1.492 1.628 0 C-N-CA 123.084 0.554 . . . . 74.14 110.431 173.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -66.24 -26.74 48.96 Favored 'Trans proline' 0 C--N 1.379 2.137 0 C-N-CA 122.653 2.235 . . . . 72.14 113.512 -171.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -71.76 -38.77 70.33 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.46 0.704 . . . . 74.32 111.32 178.264 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 12.0 mp0 -70.75 -35.14 72.5 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.174 0.59 . . . . 73.34 110.849 176.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 86.1 t -62.4 -47.36 93.37 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 C-N-CA 123.375 0.67 . . . . 72.13 111.26 174.475 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 90.9 p -65.67 -41.7 92.18 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.35 0.66 . . . . 74.11 112.161 -177.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -64.92 -48.97 72.25 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 122.675 0.39 . . . . 72.42 111.63 177.018 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.454 ' NH1' ' HB3' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -70.08 -23.98 63.16 Favored 'General case' 0 CA--C 1.561 1.368 0 C-N-CA 123.313 0.645 . . . . 72.53 111.215 -177.079 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.469 ' HA ' HD13 ' A' ' 60' ' ' LEU . 23.9 t80 -61.13 -49.29 77.86 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 123.979 0.912 . . . . 75.1 111.556 170.71 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -73.88 -24.42 59.73 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 115.465 -0.789 . . . . 74.25 111.143 -178.801 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -72.35 -32.81 66.79 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.58 0.752 . . . . 75.24 111.102 171.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.567 HD22 ' HB2' ' A' ' 22' ' ' ASP . 15.3 mt -58.58 -55.54 33.79 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.415 0.686 . . . . 72.3 111.142 173.218 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' MET . . . . . 0.46 ' HA ' ' HE2' ' A' ' 61' ' ' MET . 27.9 mmt . . . . . 0 N--CA 1.484 1.259 0 C-N-CA 123.015 0.526 . . . . 73.41 112.018 178.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 29.4 m . . . . . 0 N--CA 1.489 1.516 0 CA-C-O 120.314 0.102 . . . . 63.13 110.904 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 48.2 m80 -68.32 151.14 47.34 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.039 0.536 . . . . 73.14 112.181 -179.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 60.8 mtt -69.7 104.55 2.44 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 115.585 -0.734 . . . . 63.24 110.295 177.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 40.7 mtmt 68.77 171.71 0.29 Allowed 'General case' 0 N--CA 1.496 1.866 0 C-N-CA 125.114 1.366 . . . . 74.22 112.614 -176.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -155.88 147.12 22.52 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.623 0.769 . . . . 74.4 110.762 175.293 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 35.5 m -112.13 4.75 8.33 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 C-N-CA 123.444 0.697 . . . . 74.04 111.765 177.431 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.5 mp -88.79 102.91 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.096 0 C-N-CA 123.345 0.658 . . . . 73.12 109.259 -179.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 50.9 tttm -156.91 113.62 3.04 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 122.732 0.413 . . . . 71.15 111.439 -176.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.571 ' H ' HD13 ' A' ' 63' ' ' LEU . 59.6 mttp -100.02 167.93 10.17 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.549 0.739 . . . . 73.54 110.955 168.566 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.511 ' HB3' ' HZ1' ' A' ' 10' ' ' LYS . 7.5 mtpm? -84.62 124.72 31.76 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 123.316 0.646 . . . . 74.42 110.92 178.367 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -98.14 16.59 59.88 Favored Glycine 0 N--CA 1.481 1.638 0 C-N-CA 122.574 0.13 . . . . 64.05 112.778 177.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.529 ' HB3' HH21 ' A' ' 56' ' ' ARG . 0.6 OUTLIER -151.26 154.72 37.33 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.872 0.869 . . . . 65.32 111.681 -173.564 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.446 HG23 HG23 ' A' ' 14' ' ' ILE . 3.3 mp -105.96 -50.75 8.25 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.252 0 C-N-CA 124.078 0.951 . . . . 73.13 110.876 -175.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.446 HG23 HG23 ' A' ' 13' ' ' ILE . 30.3 pt -122.26 5.7 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.162 0 C-N-CA 123.698 0.799 . . . . 72.12 112.877 -175.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 54.9 mt -100.24 139.0 22.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 C-N-CA 123.189 0.595 . . . . 74.21 110.659 -176.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 59.8 tp -78.32 103.22 8.12 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.35 0.66 . . . . 75.25 111.766 -176.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 90.9 m95 -131.87 128.9 39.6 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.566 0.746 . . . . 74.31 110.389 174.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 44.8 p -126.16 169.44 12.83 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.117 0.567 . . . . 65.02 111.201 179.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -51.9 -33.11 35.45 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 124.831 1.252 . . . . 75.02 114.063 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 14.6 t-20 -73.52 -34.73 65.38 Favored 'General case' 0 CA--C 1.558 1.267 0 C-N-CA 123.094 0.558 . . . . 71.44 111.244 -176.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -69.71 -52.38 26.07 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.307 0.643 . . . . 73.01 112.013 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -58.83 -31.63 68.65 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.852 0.861 . . . . 72.34 112.549 -178.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 74.4 ttt180 -62.59 -46.2 89.41 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 122.29 0.236 . . . . 75.32 111.068 174.145 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 36.8 t -63.37 -39.15 84.21 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 C-N-CA 123.253 0.621 . . . . 74.4 111.092 -179.087 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.411 ' HA ' HD12 ' A' ' 42' ' ' LEU . 87.0 mt -54.81 -57.79 5.79 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.238 0 C-N-CA 123.225 0.61 . . . . 75.34 110.95 175.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.41 ' HG ' HD12 ' A' ' 60' ' ' LEU . 94.2 mt -63.05 -34.07 76.79 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.399 0.68 . . . . 72.45 112.142 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 31.7 tp -65.01 -53.39 46.9 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.428 0.691 . . . . 75.43 111.626 -177.259 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 48.1 mm-40 -75.76 -24.63 56.08 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 122.846 0.458 . . . . 74.12 112.2 179.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 41.5 t -68.94 -38.5 79.51 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 122.677 0.391 . . . . 64.41 111.364 177.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -80.75 -35.18 33.67 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.232 0.613 . . . . 73.35 111.203 177.184 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -64.28 -47.15 80.64 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 123.531 0.732 . . . . 71.41 111.852 177.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 36.8 mtt180 -104.6 -68.21 0.86 Allowed 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.649 0.78 . . . . 72.34 110.719 -173.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 145.81 135.51 2.81 Favored Glycine 0 CA--C 1.534 1.227 0 CA-C-O 118.885 -0.953 . . . . 74.33 110.912 -172.024 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -66.76 87.75 0.29 Allowed 'Trans proline' 0 CA--C 1.561 1.872 0 C-N-CA 122.716 2.278 . . . . 72.23 113.342 -178.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 98.7 p -126.55 163.45 23.38 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.128 0.971 . . . . 71.52 110.149 178.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 68.8 p -55.15 -39.82 69.9 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 123.953 0.901 . . . . 71.23 113.027 -179.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 63.7 pttt -73.76 -25.98 60.42 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.496 0.718 . . . . 73.52 112.335 179.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 86.4 m -76.1 -39.56 54.98 Favored 'General case' 0 N--CA 1.484 1.24 0 N-CA-C 108.87 -0.789 . . . . 73.24 108.87 175.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -67.16 -28.83 68.45 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 115.322 -0.854 . . . . 75.1 111.254 173.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.404 ' HA ' ' HG3' ' A' ' 50' ' ' PRO . . . -73.09 -35.95 66.71 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.749 0.82 . . . . 65.32 111.863 175.097 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -62.71 -50.37 71.39 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.184 0.594 . . . . 74.22 110.406 171.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.411 HD12 ' HA ' ' A' ' 25' ' ' ILE . 76.3 mt -66.21 -25.64 67.02 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.555 1.142 . . . . 74.34 112.192 177.229 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.39 -58.48 5.2 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.315 0.646 . . . . 64.03 111.117 175.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.84 -36.15 76.23 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 123.5 0.72 . . . . 51.41 111.945 178.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.25 -49.75 70.67 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 124.175 0.99 . . . . 74.55 111.81 176.217 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 52.3 mt -99.5 14.6 29.32 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 113.196 0.813 . . . . 74.34 113.196 -170.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 68.25 13.96 9.14 Favored 'General case' 0 N--CA 1.508 2.434 0 C-N-CA 125.071 1.349 . . . . 74.01 113.211 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -103.48 -176.72 3.16 Favored 'General case' 0 N--CA 1.483 1.182 0 CA-C-O 121.768 0.794 . . . . 75.22 112.843 -173.549 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -102.76 153.91 37.88 Favored Pre-proline 0 CA--C 1.559 1.296 0 CA-C-N 115.003 -0.999 . . . . 65.03 109.421 166.484 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.404 ' HG3' ' HA ' ' A' ' 40' ' ' ALA . 92.0 Cg_exo -47.11 -35.12 18.7 Favored 'Trans proline' 0 C--N 1.388 2.645 0 C-N-CA 123.623 2.882 . . . . 75.21 114.631 177.174 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.419 ' O ' ' HG3' ' A' ' 55' ' ' GLU . 78.8 m-20 -59.63 -50.55 73.42 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.613 0.765 . . . . 75.5 111.585 176.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 83.1 mm-40 -55.83 -46.43 78.13 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 123.56 0.744 . . . . 75.41 112.111 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.405 HG12 ' HB2' ' A' ' 42' ' ' LEU . 76.8 t -64.74 -45.78 94.14 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 CA-C-N 115.163 -0.926 . . . . 71.53 111.631 -178.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.3 t -59.47 -44.13 93.08 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.303 0.641 . . . . 62.54 111.941 179.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.419 ' HG3' ' O ' ' A' ' 51' ' ' ASN . 60.0 mt-10 -57.78 -50.82 71.97 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.127 0.571 . . . . 74.0 111.435 177.693 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.529 HH21 ' HB3' ' A' ' 12' ' ' GLU . 40.3 mmt-85 -68.78 -35.2 76.75 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 122.677 0.391 . . . . 75.13 111.908 -176.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -52.77 -52.77 55.25 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.422 0.689 . . . . 71.35 110.964 170.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -69.61 -25.14 63.81 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 115.337 -0.847 . . . . 64.54 112.133 -176.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.443 ' O ' ' HG ' ' A' ' 63' ' ' LEU . 30.9 mm-40 -68.56 -54.42 16.74 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 109.373 -0.602 . . . . 72.4 109.373 172.406 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.41 HD12 ' HG ' ' A' ' 26' ' ' LEU . 21.0 mt -47.61 -48.02 28.53 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 125.02 1.328 . . . . 63.41 112.607 179.015 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.452 ' HA ' ' HE1' ' A' ' 61' ' ' MET . 23.7 mmt -58.62 -51.31 70.47 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 123.297 0.639 . . . . 72.43 111.667 178.064 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 58.0 mtpt -65.04 -27.1 68.57 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.848 0.859 . . . . 74.54 112.724 -179.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.571 HD13 ' H ' ' A' ' 9' ' ' LYS . 96.0 mt -70.78 -37.42 73.33 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.296 0.638 . . . . 74.42 111.636 175.256 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -74.24 -30.8 62.32 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 122.584 0.354 . . . . 74.05 111.56 177.189 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -78.5 -58.83 3.05 Favored 'General case' 0 CA--C 1.558 1.264 0 C-N-CA 123.192 0.597 . . . . 75.32 112.41 179.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.9 mppt? -110.93 -58.55 2.08 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.597 0.759 . . . . 74.24 112.127 -175.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 33.9 t 67.53 -66.98 0.19 Allowed 'General case' 0 N--CA 1.501 2.121 0 C-N-CA 125.168 1.387 . . . . 64.51 112.391 -172.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp 64.83 -169.98 0.2 Allowed 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 125.136 1.374 . . . . 75.23 112.794 177.317 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 75.8 m -142.15 103.3 4.27 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.181 0.593 . . . . 73.34 110.56 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 25.9 ttm180 . . . . . 0 CA--C 1.561 1.366 0 C-N-CA 123.421 0.688 . . . . 74.4 110.06 178.799 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 23.1 t . . . . . 0 N--CA 1.494 1.726 0 N-CA-C 110.647 -0.131 . . . . 73.21 110.647 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 59.7 m-70 -74.11 85.73 1.85 Allowed 'General case' 0 CA--C 1.555 1.165 0 C-N-CA 123.388 0.675 . . . . 71.22 110.663 -179.31 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 21.3 ttt -110.97 145.09 39.02 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.415 0.686 . . . . 75.44 110.358 -175.048 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 66.5 mmtt 66.18 93.34 0.07 Allowed 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 124.581 1.152 . . . . 74.12 111.684 -171.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 41.7 m-20 -95.97 83.38 3.65 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 108.825 -0.805 . . . . 75.33 108.825 173.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 46.3 t -70.01 101.11 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.041 0 C-N-CA 123.163 0.585 . . . . 71.35 111.149 -171.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 35.3 pt -71.8 148.21 10.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 CA-C-N 115.828 -0.624 . . . . 74.31 111.303 175.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.6 pttt -159.93 176.44 11.88 Favored 'General case' 0 N--CA 1.48 1.068 0 CA-C-N 115.784 -0.644 . . . . 75.32 111.936 -171.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.7 pttp -64.19 152.1 41.68 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.223 1.009 . . . . 75.42 113.163 -177.362 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.6 tmtt? -128.27 78.54 1.84 Allowed 'General case' 0 CA--C 1.554 1.126 0 N-CA-C 108.27 -1.011 . . . . 74.13 108.27 172.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -120.91 24.77 7.37 Favored Glycine 0 N--CA 1.477 1.413 0 CA-C-N 115.602 -0.726 . . . . 71.52 112.001 174.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -125.86 121.83 34.35 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.197 0.999 . . . . 75.15 110.021 -174.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.586 HG21 ' H ' ' A' ' 15' ' ' ILE . 59.0 mt 69.61 137.95 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 C-N-CA 125.526 1.53 . . . . 74.42 112.376 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 32.2 pt -68.24 -22.83 27.88 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 C-N-CA 123.79 0.836 . . . . 65.14 113.159 -178.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.586 ' H ' HG21 ' A' ' 13' ' ' ILE . 16.4 mt -84.84 130.17 36.49 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.194 0 C-N-CA 124.032 0.933 . . . . 74.15 110.223 -178.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -79.56 132.25 36.24 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.255 0.622 . . . . 75.12 109.924 175.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -137.9 130.39 29.42 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.631 0.772 . . . . 75.44 110.195 176.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 30.7 p -135.38 168.57 18.97 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 124.137 0.975 . . . . 60.11 110.448 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 14.5 ptm180 -57.9 -28.33 64.12 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 113.976 1.102 . . . . 73.51 113.976 -171.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -68.82 -34.53 75.66 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.263 0.625 . . . . 71.43 111.463 178.002 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.429 ' HA ' HD22 ' A' ' 46' ' ' LEU . 47.8 m-20 -66.48 -57.7 6.79 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.003 0.521 . . . . 74.45 110.718 175.218 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -54.26 -39.01 66.46 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.506 1.122 . . . . 73.11 112.781 -179.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 61.3 ttt-85 -60.1 -50.33 74.13 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.191 0.597 . . . . 75.34 111.938 178.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 38.4 t -75.0 -31.71 25.63 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 122.708 0.403 . . . . 73.21 111.048 -174.154 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 75.1 mt -60.84 -48.57 88.32 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 C-N-CA 122.146 0.178 . . . . 75.41 110.621 172.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 96.3 mt -66.62 -34.8 78.67 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 123.186 0.594 . . . . 73.15 112.317 177.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 64.2 tp -61.87 -48.08 82.13 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.66 0.784 . . . . 74.2 111.298 177.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.545 ' HB3' HG23 ' A' ' 38' ' ' THR . 26.4 mm-40 -72.56 -32.42 66.04 Favored 'General case' 0 CA--C 1.551 0.988 0 CA-C-N 114.767 -1.106 . . . . 75.33 112.088 176.284 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . 0.444 ' SG ' ' HE1' ' A' ' 57' ' ' PHE . 13.9 t -65.45 -35.46 80.98 Favored 'General case' 0 N--CA 1.491 1.598 0 C-N-CA 123.714 0.805 . . . . 73.32 112.212 179.478 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -90.39 -3.95 57.37 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.057 0.543 . . . . 72.43 111.963 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 27.0 tptp -113.15 -73.3 0.67 Allowed 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 123.123 0.569 . . . . 71.23 110.74 178.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 61.5 mtt180 -81.21 -10.61 59.58 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.257 0.623 . . . . 72.04 112.435 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 82.21 -165.22 44.8 Favored Glycine 0 CA--C 1.538 1.529 0 N-CA-C 114.611 0.604 . . . . 72.11 114.611 173.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -82.39 35.78 0.59 Allowed 'Trans proline' 0 C--N 1.374 1.906 0 C-N-CA 123.54 2.827 . . . . 64.22 113.557 176.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 65.4 m -76.34 152.66 36.29 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.166 0.586 . . . . 65.15 112.182 -177.651 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 87.5 p -63.7 -30.09 71.23 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 123.252 0.621 . . . . 73.4 110.462 168.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -55.37 -40.04 70.83 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 124.417 1.087 . . . . 73.13 110.977 170.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.545 HG23 ' HB3' ' A' ' 28' ' ' GLU . 32.2 m -75.76 -47.32 26.41 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 114.827 -1.079 . . . . 73.25 109.414 -174.248 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 21.1 m-85 -63.71 -30.43 71.53 Favored 'General case' 0 CA--C 1.551 0.997 0 CA-C-N 114.802 -1.09 . . . . 75.31 112.042 178.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.79 -42.57 77.16 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.421 0.688 . . . . 71.24 111.341 175.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -61.28 -55.75 28.38 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 122.791 0.436 . . . . 72.33 110.522 174.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 72.8 mt -61.47 -25.65 67.38 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.486 1.115 . . . . 75.44 113.107 -178.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.47 -56.13 18.6 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-O 121.153 0.502 . . . . 74.34 111.231 173.085 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -71.66 -30.63 65.94 Favored 'General case' 0 N--CA 1.482 1.174 0 CA-C-N 116.014 -0.539 . . . . 62.41 112.213 -178.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 8.5 tmtm? -73.91 -53.78 9.4 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.988 0.915 . . . . 75.12 110.659 -176.36 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.429 HD22 ' HA ' ' A' ' 21' ' ' ASP . 88.3 mt -86.73 3.06 46.48 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.262 0.625 . . . . 74.13 112.67 -175.667 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.0 t70 60.5 34.21 20.44 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-O 122.372 1.082 . . . . 63.45 110.666 -175.336 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 47.5 mmtm -107.17 -177.86 3.48 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 115.0 -1.0 . . . . 74.02 111.291 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.465 ' N ' HD21 ' A' ' 49' ' ' ASN . 0.7 OUTLIER -105.37 148.28 36.03 Favored Pre-proline 0 CA--C 1.554 1.131 0 N-CA-C 108.84 -0.8 . . . . 73.13 108.84 172.445 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_exo -53.4 -34.95 73.53 Favored 'Trans proline' 0 C--N 1.384 2.441 0 C-N-CA 122.746 2.297 . . . . 75.31 114.329 178.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 23.8 m120 -68.06 -44.72 75.69 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.654 0.382 . . . . 72.22 111.267 174.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.462 ' HG3' ' HB2' ' A' ' 49' ' ' ASN . 96.5 mt-30 -57.75 -45.4 85.93 Favored 'General case' 0 N--CA 1.494 1.73 0 C-N-CA 123.037 0.535 . . . . 71.13 111.393 176.25 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 87.9 t -63.83 -50.88 75.7 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.896 0 C-N-CA 123.717 0.807 . . . . 73.54 111.628 -179.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.447 ' O ' ' HG3' ' A' ' 58' ' ' GLN . 90.2 p -60.78 -43.41 98.13 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.185 0.594 . . . . 74.14 112.21 -176.313 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.425 ' O ' ' HG2' ' A' ' 59' ' ' GLN . 44.0 mt-10 -67.05 -43.66 82.16 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.148 0.579 . . . . 74.01 111.871 178.427 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 22.1 tpt180 -62.9 -39.95 96.1 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 123.137 0.575 . . . . 74.23 111.396 177.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.444 ' HE1' ' SG ' ' A' ' 29' ' ' CYS . 3.5 t80 -52.37 -48.3 65.67 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.547 1.139 . . . . 74.42 111.045 172.365 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.447 ' HG3' ' O ' ' A' ' 54' ' ' SER . 49.6 mt-30 -66.74 -34.51 78.0 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 115.851 -0.613 . . . . 74.12 111.532 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.425 ' HG2' ' O ' ' A' ' 55' ' ' GLU . 11.7 mm-40 -69.96 -33.36 71.99 Favored 'General case' 0 N--CA 1.486 1.345 0 CA-C-O 120.893 0.378 . . . . 75.43 110.579 177.905 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.443 HD23 HD12 ' A' ' 63' ' ' LEU . 32.8 mt -62.38 -41.91 99.0 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.059 0.944 . . . . 74.21 111.331 170.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 34.5 mmt -60.53 -40.24 90.77 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 123.388 0.675 . . . . 74.4 111.057 175.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.76 -27.94 68.67 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.744 0.818 . . . . 73.55 112.556 176.029 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.443 HD12 HD23 ' A' ' 60' ' ' LEU . 97.0 mt -68.37 -36.63 79.48 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 122.793 0.437 . . . . 75.53 111.789 176.044 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -64.67 -37.78 88.75 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 122.998 0.519 . . . . 75.01 111.46 175.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 53.5 mt-10 -70.03 -48.67 57.01 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.019 0.528 . . . . 71.41 110.77 175.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 53.2 tttm 71.7 -53.53 0.68 Allowed 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 126.651 1.981 . . . . 54.15 113.246 179.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 44.3 t -52.45 -36.32 54.36 Favored 'General case' 0 N--CA 1.499 1.98 0 C-N-CA 124.019 0.928 . . . . 72.35 112.88 176.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 56.8 tptt -68.13 -56.59 8.25 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 123.176 0.59 . . . . 73.0 110.961 175.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 42.0 t 53.91 75.37 0.28 Allowed 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 124.383 1.073 . . . . 60.01 111.797 -178.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 48.0 ttp180 . . . . . 0 CA--C 1.572 1.805 0 C-N-CA 125.042 1.337 . . . . 74.31 111.68 -175.358 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 40.1 t . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.898 0.38 . . . . 64.53 110.862 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 86.2 m-70 -126.82 136.34 52.24 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.722 0.809 . . . . 70.42 110.216 178.281 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 60.1 mtt -90.66 -178.55 5.31 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.065 0.546 . . . . 74.13 110.011 168.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.646 ' HZ2' ' HB3' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -79.68 87.11 5.22 Favored 'General case' 0 CA--C 1.555 1.158 0 N-CA-C 107.872 -1.158 . . . . 72.12 107.872 172.632 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 -137.95 99.36 3.88 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 123.767 0.827 . . . . 75.23 110.074 178.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 18.5 m -93.83 106.4 18.0 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.079 0 CA-C-O 121.428 0.632 . . . . 75.14 110.427 176.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.661 ' HB ' ' HA ' ' A' ' 64' ' ' PHE . 2.9 mp -89.79 3.01 6.55 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.65 0 CA-C-O 121.64 0.733 . . . . 73.22 109.458 175.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -65.88 91.64 0.15 Allowed 'General case' 0 CA--C 1.558 1.28 0 C-N-CA 124.138 0.975 . . . . 75.23 110.427 172.159 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.454 ' HB2' ' HZ1' ' A' ' 9' ' ' LYS . 4.6 ttmp? -127.93 -69.03 0.75 Allowed 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.635 0.774 . . . . 71.44 110.838 -178.241 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -88.59 96.61 10.71 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.364 0.666 . . . . 75.45 110.899 -173.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 171.0 106.87 0.19 Allowed Glycine 0 CA--C 1.53 0.982 0 CA-C-N 115.784 -0.643 . . . . 72.41 112.214 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -78.95 143.71 35.52 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.356 0.662 . . . . 73.44 111.675 -178.595 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.498 HD13 ' HB2' ' A' ' 17' ' ' TRP . 13.6 pt -132.18 125.6 54.63 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.161 0 C-N-CA 124.262 1.025 . . . . 72.14 110.68 179.584 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 41.8 mm -81.21 -41.67 19.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 123.386 0.674 . . . . 64.22 110.399 178.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 33.8 mt -73.02 144.62 12.66 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 CA-C-N 114.765 -1.107 . . . . 61.24 110.152 178.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.0 mp -66.81 89.21 0.15 Allowed 'General case' 0 CA--C 1.559 1.295 0 C-N-CA 123.614 0.766 . . . . 75.54 110.967 -179.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . 0.498 ' HB2' HD13 ' A' ' 13' ' ' ILE . 79.3 m95 -118.38 109.07 15.83 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.98 0.912 . . . . 74.41 109.851 177.201 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 19.4 p -108.48 168.29 9.43 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 122.245 -0.284 . . . . 74.41 110.684 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 24.1 ptt-85 -53.85 -21.78 8.38 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 124.401 1.081 . . . . 74.34 112.912 176.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 22.8 m-80 -74.14 -49.6 23.04 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.359 0.664 . . . . 74.2 110.329 175.289 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -60.29 -58.95 6.34 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.895 0.878 . . . . 71.02 111.768 -178.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.549 ' HB2' HD23 ' A' ' 60' ' ' LEU . 2.1 p30 -66.2 -31.67 72.63 Favored 'General case' 0 CA--C 1.558 1.282 0 N-CA-C 113.268 0.84 . . . . 74.42 113.268 -172.492 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 34.9 ttt180 -60.23 -44.06 95.52 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 123.487 0.715 . . . . 73.31 111.64 173.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 80.3 t -66.52 -37.61 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 C-N-CA 123.225 0.61 . . . . 75.03 111.201 177.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 78.1 mt -58.13 -56.2 17.45 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 122.749 0.42 . . . . 74.13 111.151 176.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.573 ' HG ' HD12 ' A' ' 60' ' ' LEU . 78.5 mt -57.99 -37.32 74.02 Favored 'General case' 0 N--CA 1.484 1.231 0 N-CA-C 112.322 0.49 . . . . 63.12 112.322 179.148 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 46.4 tp -63.65 -51.56 64.63 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.591 0.756 . . . . 74.34 112.447 -178.703 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -77.97 -22.24 49.72 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 112.679 0.622 . . . . 74.53 112.679 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 80.3 m -75.35 -41.66 56.05 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 112.215 0.45 . . . . 74.32 112.215 177.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -70.14 -29.25 66.13 Favored 'General case' 0 N--CA 1.491 1.625 0 C-N-CA 122.711 0.404 . . . . 74.43 111.204 175.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -73.98 -66.9 0.66 Allowed 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 124.045 0.938 . . . . 73.51 111.212 177.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 60.7 mtt-85 -80.41 -56.85 3.9 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.193 0.997 . . . . 73.24 111.328 -171.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 129.71 154.78 8.23 Favored Glycine 0 CA--C 1.538 1.523 0 CA-C-O 119.356 -0.691 . . . . 72.32 112.499 -177.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_exo -65.46 94.3 0.25 Allowed 'Trans proline' 0 C--N 1.377 2.042 0 C-N-CA 123.27 2.647 . . . . 74.43 112.684 176.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 67.3 m -142.24 155.64 45.26 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 124.07 0.948 . . . . 74.13 110.587 -178.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 91.2 p -59.92 -40.31 88.43 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 123.319 0.647 . . . . 63.42 112.411 -176.909 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 38.6 mtmm -68.37 -24.41 64.79 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.041 0.537 . . . . 73.14 112.337 176.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 68.5 m -78.19 -43.05 29.59 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 109.225 -0.657 . . . . 64.32 109.225 -179.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -72.07 -29.19 63.89 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 115.267 -0.879 . . . . 73.24 111.563 176.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.15 -34.72 61.65 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.518 0.727 . . . . 74.02 111.329 174.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 86.2 t80 -63.91 -48.53 76.25 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 122.995 0.518 . . . . 73.41 110.392 172.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.413 ' HB2' HG12 ' A' ' 53' ' ' VAL . 81.7 mt -66.36 -27.28 67.76 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.26 1.024 . . . . 72.02 112.109 176.255 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.83 -42.32 86.02 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.074 0.55 . . . . 72.54 111.207 172.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.42 -34.88 68.17 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.157 0.583 . . . . 61.31 111.478 175.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 58.8 tptt -67.21 -40.25 86.41 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.843 1.257 . . . . 75.44 111.358 -179.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 46.8 mt -109.26 12.23 24.96 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.807 0.843 . . . . 74.01 112.263 -175.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.7 p30 49.49 22.77 0.78 Allowed 'General case' 0 N--CA 1.51 2.527 0 C-N-CA 126.327 1.851 . . . . 74.34 114.75 -175.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 44.9 mmtm -99.67 -172.17 2.2 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.838 0.855 . . . . 72.5 111.319 179.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 -98.71 145.57 30.15 Favored Pre-proline 0 N--CA 1.489 1.512 0 C-N-CA 123.495 0.718 . . . . 73.25 110.52 176.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_exo -57.76 -32.73 95.54 Favored 'Trans proline' 0 C--N 1.387 2.558 0 C-N-CA 123.293 2.662 . . . . 61.11 113.839 -178.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -61.46 -48.93 78.89 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.998 0.919 . . . . 71.04 111.25 174.357 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -63.3 -41.35 98.95 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.822 0.849 . . . . 75.42 111.396 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.413 HG12 ' HB2' ' A' ' 42' ' ' LEU . 93.9 t -65.49 -42.99 94.51 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 C-N-CA 123.878 0.871 . . . . 74.55 111.441 177.787 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 37.8 t -64.2 -44.14 92.88 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.69 0.796 . . . . 73.34 111.904 -178.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.405 ' O ' ' HG3' ' A' ' 59' ' ' GLN . 47.4 mt-10 -65.97 -42.7 89.58 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.229 0.612 . . . . 62.24 111.327 174.431 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 32.2 tpt180 -60.86 -41.76 96.53 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.284 0.633 . . . . 73.24 111.414 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -53.08 -48.27 67.88 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 124.247 1.019 . . . . 72.13 111.385 173.062 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -75.17 -24.67 57.92 Favored 'General case' 0 CA--C 1.555 1.145 0 CA-C-N 115.168 -0.923 . . . . 75.2 112.315 -178.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.405 ' HG3' ' O ' ' A' ' 55' ' ' GLU . 98.0 mt-30 -68.36 -45.03 73.9 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 109.448 -0.575 . . . . 73.34 109.448 171.579 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.573 HD12 ' HG ' ' A' ' 26' ' ' LEU . 31.6 mt -56.01 -56.37 21.58 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.381 1.072 . . . . 72.44 111.75 175.464 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.564 ' HA ' ' HE1' ' A' ' 61' ' ' MET . 17.2 mmt -65.62 -29.25 69.81 Favored 'General case' 0 N--CA 1.481 1.095 0 N-CA-C 112.696 0.628 . . . . 72.42 112.696 -178.102 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -76.58 -43.6 38.09 Favored 'General case' 0 N--CA 1.484 1.232 0 N-CA-C 112.358 0.503 . . . . 71.22 112.358 177.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 84.3 mt -75.86 -42.62 48.85 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 123.192 0.597 . . . . 73.31 111.67 -178.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.661 ' HA ' ' HB ' ' A' ' 7' ' ' ILE . 18.6 m-85 -64.44 -22.28 66.91 Favored 'General case' 0 N--CA 1.493 1.697 0 C-N-CA 123.462 0.705 . . . . 64.11 111.722 173.702 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -73.6 -62.64 1.42 Allowed 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 108.832 -0.803 . . . . 74.34 108.832 169.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -161.15 121.87 2.79 Favored 'General case' 0 N--CA 1.493 1.712 0 C-N-CA 125.837 1.655 . . . . 73.23 108.687 177.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 65.0 m -62.39 116.49 5.11 Favored 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 112.626 0.602 . . . . 72.13 112.626 179.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 53.1 tttp -77.8 118.93 20.62 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 123.597 0.759 . . . . 74.42 109.424 173.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 46.7 t -78.98 66.2 4.36 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.544 0.738 . . . . 74.32 112.425 -173.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 6.5 tpm_? . . . . . 0 C--O 1.256 1.397 0 C-N-CA 124.511 1.124 . . . . 75.05 110.763 175.248 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 41.1 t . . . . . 0 N--CA 1.497 1.892 0 CA-C-O 120.586 0.231 . . . . 64.05 111.387 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 50.1 m80 -124.41 98.09 5.59 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.577 0.751 . . . . 72.03 109.865 177.008 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 84.2 mtp -122.73 108.12 12.7 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.359 0.664 . . . . 54.43 111.595 -175.1 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 54.9 pttt -106.17 111.16 23.66 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.548 0.739 . . . . 75.54 109.349 169.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -65.51 120.13 12.31 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 122.789 0.436 . . . . 70.43 111.478 -177.029 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.4 p -63.85 97.22 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.562 1.421 0 C-N-CA 123.576 0.75 . . . . 64.03 111.057 179.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 31.2 pt -67.81 92.26 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.559 1.31 0 CA-C-O 122.353 1.073 . . . . 74.4 111.655 -177.698 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -78.24 113.89 16.62 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 115.201 -0.909 . . . . 75.54 110.878 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -84.8 151.89 24.03 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 123.106 0.563 . . . . 73.32 110.113 171.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 34.1 ttpt 64.99 102.2 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 124.702 1.201 . . . . 73.21 112.098 -176.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -85.2 126.57 7.77 Favored Glycine 0 C--N 1.342 0.915 0 N-CA-C 110.333 -1.107 . . . . 71.43 110.333 166.605 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -61.62 143.51 55.96 Favored 'General case' 0 CA--C 1.562 1.43 0 CA-C-N 117.528 0.664 . . . . 72.52 112.701 -175.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 59.5 mt -79.89 152.57 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 C-N-CA 123.946 0.898 . . . . 73.22 109.772 178.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 71.8 mt 75.97 -61.59 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 C-N-CA 125.192 1.397 . . . . 75.11 110.532 -171.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.43 HG21 ' NE2' ' A' ' 52' ' ' GLN . 10.8 pt -114.23 114.32 46.34 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 C-N-CA 124.521 1.129 . . . . 71.53 111.191 -178.422 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 37.8 tp -81.67 78.18 8.43 Favored 'General case' 0 CA--C 1.552 1.02 0 CA-C-O 121.559 0.695 . . . . 72.21 111.094 -178.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . 0.421 ' HH2' HG22 ' A' ' 53' ' ' VAL . 90.8 m95 -65.87 119.99 12.27 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-N 115.326 -0.852 . . . . 75.35 110.545 165.219 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 44.5 p -116.89 169.82 9.09 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 123.092 0.557 . . . . 72.25 110.222 176.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 16.7 ptt180 -57.81 -20.84 38.58 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 112.32 0.489 . . . . 72.24 112.32 177.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.413 ' O ' HG22 ' A' ' 24' ' ' VAL . 27.2 m-80 -70.19 -50.63 38.22 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.227 0.611 . . . . 73.43 110.391 175.453 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.461 ' HA ' HD21 ' A' ' 46' ' ' LEU . 16.5 m-20 -65.12 -54.8 24.36 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.239 0.616 . . . . 64.42 111.068 -179.712 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.567 ' HB3' HD22 ' A' ' 60' ' ' LEU . 1.2 m-20 -54.76 -39.38 68.27 Favored 'General case' 0 CA--C 1.559 1.295 0 C-N-CA 124.915 1.286 . . . . 74.22 113.223 -179.384 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 17.5 tpt180 -65.2 -44.81 87.14 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 122.512 0.325 . . . . 74.42 111.484 177.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.413 HG22 ' O ' ' A' ' 20' ' ' ASN . 57.7 t -67.69 -31.02 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 C-N-CA 122.787 0.435 . . . . 73.51 112.086 -176.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 87.9 mt -55.02 -56.41 11.14 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.417 0 CA-C-O 120.826 0.346 . . . . 63.31 110.432 169.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.401 HD13 ' HB3' ' A' ' 60' ' ' LEU . 68.2 mt -65.22 -28.87 69.67 Favored 'General case' 0 CA--C 1.556 1.209 0 C-N-CA 123.314 0.645 . . . . 75.3 112.198 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 61.1 tp -69.11 -48.81 61.55 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.432 0.693 . . . . 65.31 111.518 177.165 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.416 ' HA ' ' HB3' ' A' ' 31' ' ' LYS . 11.2 mm-40 -76.81 -19.19 57.84 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.115 0.566 . . . . 73.43 112.436 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 98.6 m -74.62 -33.25 62.53 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 112.104 0.409 . . . . 74.44 112.104 174.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -85.37 -24.04 27.74 Favored 'General case' 0 N--CA 1.493 1.712 0 C-N-CA 122.481 0.313 . . . . 75.12 111.413 172.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.416 ' HB3' ' HA ' ' A' ' 28' ' ' GLU . 60.6 tptt -84.26 -71.57 0.51 Allowed 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.721 0.808 . . . . 75.52 110.953 179.196 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.468 ' HD3' HG21 ' A' ' 38' ' ' THR . 39.9 ttt180 -79.11 -42.52 26.1 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 124.489 1.115 . . . . 74.54 111.824 -176.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 125.62 147.66 7.02 Favored Glycine 0 CA--C 1.54 1.6 0 CA-C-O 119.317 -0.713 . . . . 53.22 112.849 179.388 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -73.75 107.48 2.42 Favored 'Trans proline' 0 C--N 1.378 2.085 0 C-N-CA 123.114 2.543 . . . . 75.01 112.118 178.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 48.5 t -156.1 151.24 26.5 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.419 0.688 . . . . 60.12 110.814 -178.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 64.7 p -64.13 -27.79 69.33 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 122.928 0.491 . . . . 75.43 111.32 175.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 40.4 tttm -72.83 -21.66 60.92 Favored 'General case' 0 CA--C 1.561 1.376 0 C-N-CA 123.986 0.914 . . . . 74.4 110.665 175.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.468 HG21 ' HD3' ' A' ' 32' ' ' ARG . 81.5 m -86.96 -34.37 19.34 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 124.318 1.047 . . . . 74.45 110.015 173.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.436 ' HD1' HD13 ' A' ' 42' ' ' LEU . 21.5 m-85 -71.38 -28.34 63.97 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.434 0.694 . . . . 75.12 111.836 -179.868 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.501 ' HA ' ' HG3' ' A' ' 50' ' ' PRO . . . -67.98 -32.34 72.69 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.252 0.621 . . . . 75.44 111.44 170.477 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 50.2 t80 -76.05 -38.47 57.1 Favored 'General case' 0 CA--C 1.558 1.279 0 C-N-CA 123.596 0.758 . . . . 74.41 111.291 175.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.485 HD21 ' HD2' ' A' ' 45' ' ' LYS . 68.7 mt -66.31 -29.34 69.53 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.969 0.908 . . . . 75.42 111.263 173.335 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.57 -45.07 88.62 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 123.268 0.627 . . . . 72.32 111.203 171.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.07 -53.58 56.09 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 123.661 0.784 . . . . 73.22 112.585 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.568 ' HG3' ' HG ' ' A' ' 46' ' ' LEU . 0.2 OUTLIER -71.0 -40.23 71.94 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 112.889 0.7 . . . . 72.44 112.889 -175.844 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.568 ' HG ' ' HG3' ' A' ' 45' ' ' LYS . 81.6 mt -92.87 14.15 18.32 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 112.964 0.727 . . . . 75.42 112.964 -174.56 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.1 p30 51.2 22.45 1.34 Allowed 'General case' 0 N--CA 1.503 2.206 0 C-N-CA 125.951 1.7 . . . . 73.44 114.562 -176.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.408 ' HG2' ' O ' ' A' ' 46' ' ' LEU . 47.6 mmtm -101.72 -166.34 1.29 Allowed 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.948 0.899 . . . . 75.03 111.229 -179.587 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -127.45 146.62 59.01 Favored Pre-proline 0 CA--C 1.564 1.481 0 C-N-CA 123.259 0.624 . . . . 75.12 110.248 -179.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.501 ' HG3' ' HA ' ' A' ' 40' ' ' ALA . 59.3 Cg_exo -52.45 -38.81 74.85 Favored 'Trans proline' 0 C--N 1.389 2.668 0 C-N-CA 124.037 3.158 . . . . 74.31 115.71 -170.901 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 46.6 t-20 -59.28 -44.83 92.44 Favored 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 123.306 0.643 . . . . 74.45 110.713 177.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.43 ' NE2' HG21 ' A' ' 15' ' ' ILE . 36.9 mt-30 -67.0 -43.07 83.86 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.938 0.895 . . . . 71.13 110.777 -177.297 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.421 HG22 ' HH2' ' A' ' 17' ' ' TRP . 52.9 t -65.19 -45.81 92.77 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 CA-C-N 115.152 -0.931 . . . . 75.4 111.761 -178.879 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 80.8 p -64.3 -40.4 95.88 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.516 0.727 . . . . 75.14 111.724 -177.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -63.6 -49.59 72.74 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 116.043 -0.526 . . . . 71.43 111.176 172.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 10.9 tpt85 -60.83 -37.53 82.34 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 115.858 -0.61 . . . . 74.23 111.466 -174.034 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 29.1 t80 -53.13 -53.65 47.37 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 124.529 1.132 . . . . 72.24 112.881 176.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -73.82 -24.58 59.81 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 122.906 0.482 . . . . 73.21 111.968 -175.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 82.7 mm-40 -69.97 -42.71 72.78 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.121 0.568 . . . . 74.13 109.795 170.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.567 HD22 ' HB3' ' A' ' 22' ' ' ASP . 17.7 mt -61.71 -51.99 66.1 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.736 1.214 . . . . 54.12 112.542 -178.232 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.526 ' HA ' ' HE1' ' A' ' 61' ' ' MET . 5.7 mmt -62.08 -29.49 70.34 Favored 'General case' 0 N--CA 1.485 1.32 0 N-CA-C 112.244 0.461 . . . . 74.25 112.244 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.628 ' HZ3' ' HB2' ' A' ' 62' ' ' LYS . 4.7 ttmp? -74.92 -46.92 32.54 Favored 'General case' 0 CA--C 1.56 1.338 0 C-N-CA 123.865 0.866 . . . . 75.23 111.921 177.776 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 92.6 mt -76.68 -46.62 24.92 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.448 0.699 . . . . 74.03 112.721 -177.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -62.53 -22.61 66.43 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.519 0.728 . . . . 73.42 111.57 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -57.99 -43.77 86.77 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 123.618 0.767 . . . . 73.23 111.447 172.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -166.58 -57.65 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 123.386 0.674 . . . . 73.11 111.338 -177.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 22.0 t 60.21 -137.12 0.68 Allowed 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 124.237 1.015 . . . . 62.44 110.107 -172.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 67.3 mttm 75.8 -31.07 0.19 Allowed 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 114.84 1.422 . . . . 74.45 114.84 168.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 17.4 p -81.92 67.01 7.75 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.883 0.873 . . . . 74.22 112.457 -171.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 48.9 ttt85 . . . . . 0 CA--C 1.561 1.398 0 C-N-CA 124.677 1.191 . . . . 74.34 109.45 176.764 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.2 m . . . . . 0 N--CA 1.491 1.592 0 CA-C-O 120.264 0.078 . . . . 75.13 111.044 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 90.6 m-70 -70.53 109.78 5.03 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 122.779 0.432 . . . . 75.43 110.592 177.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 87.8 mtp -68.01 109.32 3.42 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.598 0.759 . . . . 75.52 111.345 179.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -92.45 167.75 11.75 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 123.247 0.619 . . . . 75.32 111.003 176.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -114.84 139.78 49.48 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.498 0.719 . . . . 71.55 109.778 170.126 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 69.4 t -67.6 113.44 3.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 C-N-CA 122.983 0.513 . . . . 72.45 109.902 177.28 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 16.2 tt -71.94 81.58 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.567 1.608 0 CA-C-O 122.631 1.205 . . . . 75.41 111.888 -176.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.62 83.17 1.88 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.794 1.238 . . . . 73.3 109.322 176.01 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 57.9 pttt -64.58 -37.47 87.68 Favored 'General case' 0 N--CA 1.484 1.253 0 CA-C-N 114.923 -1.035 . . . . 71.23 111.649 176.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -134.79 168.71 18.54 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.795 0.838 . . . . 73.55 111.432 -179.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 175.79 149.0 7.17 Favored Glycine 0 CA--C 1.529 0.931 0 CA-C-N 115.448 -0.796 . . . . 75.23 111.301 179.425 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -81.86 69.98 8.67 Favored 'General case' 0 CA--C 1.555 1.158 0 CA-C-O 121.695 0.76 . . . . 65.13 111.253 -178.209 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.436 HG21 ' H ' ' A' ' 15' ' ' ILE . 3.8 mp -127.08 114.68 38.16 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 N-CA-C 107.58 -1.267 . . . . 74.03 107.58 171.577 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 2.2 pp -84.7 13.23 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 C-N-CA 123.552 0.741 . . . . 72.2 112.831 -177.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.436 ' H ' HG21 ' A' ' 13' ' ' ILE . 27.1 mt -109.05 147.49 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 124.994 1.318 . . . . 75.14 109.242 177.63 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 60.4 tp -63.55 119.59 10.1 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 122.898 0.479 . . . . 64.22 110.087 171.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 86.4 m95 -147.79 138.3 23.1 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 124.41 1.084 . . . . 74.33 110.547 176.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 25.1 p -119.98 159.1 25.39 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.93 0.892 . . . . 75.05 110.259 177.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 8.7 ptp85 -64.29 -20.75 66.29 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 123.704 0.802 . . . . 72.32 112.205 174.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -67.7 -44.88 76.69 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.933 0.893 . . . . 73.54 110.312 173.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -59.48 -44.95 92.92 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 123.495 0.718 . . . . 74.11 111.772 177.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 61.4 m-20 -54.33 -44.13 71.81 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 124.859 1.264 . . . . 72.41 112.66 179.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 61.2 ttp180 -59.62 -43.68 93.7 Favored 'General case' 0 CA--C 1.556 1.184 0 CA-C-N 115.823 -0.626 . . . . 74.34 111.563 177.044 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.6 t -69.28 -38.95 78.45 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 C-N-CA 123.582 0.753 . . . . 73.12 111.534 -177.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 90.2 mt -63.72 -52.24 59.78 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 C-N-CA 122.819 0.447 . . . . 74.24 111.012 177.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 97.6 mt -58.43 -34.92 71.33 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.129 0.572 . . . . 73.02 111.813 175.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 35.2 tp -63.48 -55.28 25.37 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.183 0.593 . . . . 72.14 111.121 178.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 54.6 mm-40 -72.43 -23.77 61.12 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 112.874 0.694 . . . . 75.45 112.874 -176.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 91.3 m -69.71 -30.01 67.54 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 122.719 0.408 . . . . 60.51 111.238 175.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -86.69 -33.31 20.09 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 123.601 0.76 . . . . 75.34 111.8 174.707 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 50.9 mtpt -75.16 -74.9 0.19 Allowed 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 123.493 0.717 . . . . 73.42 111.651 178.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 27.2 mtp180 -79.91 -36.93 35.7 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 124.175 0.99 . . . . 72.42 110.353 -172.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 122.07 160.4 10.95 Favored Glycine 0 CA--C 1.538 1.497 0 CA-C-N 115.363 -0.835 . . . . 72.23 111.967 -176.425 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -77.64 38.24 0.66 Allowed 'Trans proline' 0 CA--C 1.563 1.937 0 C-N-CA 123.568 2.845 . . . . 71.54 113.593 176.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 34.8 t -75.7 154.24 36.58 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.709 0.804 . . . . 71.21 111.788 179.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 98.3 p -61.33 -34.53 75.41 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.847 0.859 . . . . 72.01 111.877 178.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt -74.46 -19.51 60.36 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.256 0.622 . . . . 74.53 112.015 177.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 51.6 m -78.17 -33.91 49.91 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 109.183 -0.673 . . . . 65.44 109.183 173.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -70.64 -30.96 67.72 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.429 0.692 . . . . 72.22 111.245 173.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.96 -36.12 77.53 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.339 0.656 . . . . 70.34 111.566 171.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 82.4 t80 -63.57 -48.68 76.46 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 123.303 0.641 . . . . 73.35 110.704 171.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.428 ' HB2' HG11 ' A' ' 53' ' ' VAL . 59.9 mt -66.77 -23.05 66.03 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 124.603 1.161 . . . . 71.24 112.303 178.218 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.87 -53.52 49.18 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.102 0.561 . . . . 73.33 111.172 171.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -71.54 -28.21 63.72 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.09 0.556 . . . . 72.35 112.436 179.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.8 -47.32 47.52 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.508 0.723 . . . . 75.41 111.247 178.686 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 52.1 mt -101.22 5.22 42.48 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.449 0.7 . . . . 71.24 112.444 -172.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 61.65 29.67 18.25 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 124.304 1.042 . . . . 72.53 112.217 -177.008 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.0 mmtm -104.0 -165.81 1.19 Allowed 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 124.565 1.146 . . . . 73.41 110.434 178.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -119.96 145.59 40.09 Favored Pre-proline 0 N--CA 1.489 1.49 0 CA-C-O 118.36 -0.829 . . . . 71.34 110.43 178.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -50.78 -46.03 32.44 Favored 'Trans proline' 0 C--N 1.385 2.487 0 C-N-CA 123.638 2.892 . . . . 75.02 114.801 -174.395 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -66.31 -41.59 89.47 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.643 0.777 . . . . 62.34 111.13 179.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -67.22 -34.7 78.03 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.725 0.81 . . . . 75.35 111.995 -178.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.428 HG11 ' HB2' ' A' ' 42' ' ' LEU . 60.6 t -71.77 -38.9 67.52 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 C-N-CA 123.016 0.526 . . . . 74.53 110.583 174.041 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.2 t -59.91 -44.46 94.26 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.954 0.901 . . . . 73.04 111.093 177.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -63.65 -43.9 95.39 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.06 0.544 . . . . 64.4 110.986 173.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 23.5 tpt180 -63.68 -35.22 79.82 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.629 0.772 . . . . 72.43 112.666 -176.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -54.71 -47.47 73.69 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.601 0.761 . . . . 74.22 110.873 171.197 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -73.95 -24.29 59.62 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 115.191 -0.913 . . . . 74.45 112.04 -178.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.422 ' O ' ' HG ' ' A' ' 63' ' ' LEU . 17.4 mm-40 -70.19 -38.04 75.24 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.111 0.564 . . . . 73.31 110.173 172.166 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 31.7 mt -60.87 -53.55 56.0 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.179 0.992 . . . . 74.34 111.577 175.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 90.1 mmm -62.7 -31.28 72.16 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 122.954 0.502 . . . . 71.32 111.651 178.422 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -65.24 -33.4 75.91 Favored 'General case' 0 CA--C 1.558 1.283 0 C-N-CA 124.238 1.015 . . . . 74.31 111.541 174.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 59' ' ' GLN . 94.6 mt -73.83 -34.05 64.4 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.215 0.606 . . . . 70.43 111.41 173.799 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -65.8 -33.46 75.92 Favored 'General case' 0 N--CA 1.494 1.773 0 C-N-CA 123.603 0.761 . . . . 73.3 111.395 175.138 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -69.66 -30.46 68.16 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.577 0.751 . . . . 73.43 111.665 174.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 45.2 mtmt 74.19 -60.5 0.52 Allowed 'General case' 0 N--CA 1.499 1.984 0 C-N-CA 125.595 1.558 . . . . 74.44 114.2 172.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 48.0 t -81.93 114.35 20.47 Favored 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 113.754 1.02 . . . . 72.42 113.754 -169.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.32 41.42 2.95 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 124.772 1.229 . . . . 75.41 109.48 168.322 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 49.3 t 77.27 -22.14 0.3 Allowed 'General case' 0 N--CA 1.499 2.002 0 C-N-CA 125.947 1.699 . . . . 73.13 114.061 177.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 14.6 mmp_? . . . . . 0 N--CA 1.493 1.676 0 C-N-CA 123.371 0.668 . . . . 74.53 111.37 177.919 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 46.0 t . . . . . 0 N--CA 1.483 1.208 0 N-CA-C 110.466 -0.198 . . . . 75.51 110.466 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 78.9 t60 64.73 146.78 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 125.128 1.371 . . . . 72.22 113.106 178.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.414 ' SD ' ' N ' ' A' ' 3' ' ' MET . 3.2 mpp? -71.84 86.04 0.96 Allowed 'General case' 0 N--CA 1.48 1.025 0 CA-C-O 121.24 0.543 . . . . 75.3 109.629 171.222 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.545 ' H ' ' HD3' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -69.68 -175.72 0.92 Allowed 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 124.011 0.925 . . . . 75.34 112.687 -176.883 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 64.28 29.47 13.72 Favored 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 124.334 1.054 . . . . 75.21 111.377 -172.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 15.8 m -68.9 -30.92 48.53 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.407 0 N-CA-C 112.647 0.61 . . . . 74.24 112.647 178.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.425 HD12 ' H ' ' A' ' 7' ' ' ILE . 2.8 mp -81.05 133.18 29.87 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 N-CA-C 109.41 -0.589 . . . . 74.35 109.41 176.772 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -76.75 156.5 32.36 Favored 'General case' 0 N--CA 1.488 1.446 0 CA-C-O 121.516 0.674 . . . . 74.3 111.515 176.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.96 29.32 1.62 Allowed 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 124.171 0.988 . . . . 75.42 110.908 -174.059 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 88.3 tttt 69.85 -67.92 0.21 Allowed 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 125.385 1.474 . . . . 72.42 111.694 -175.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -131.51 -178.19 15.33 Favored Glycine 0 N--CA 1.477 1.376 0 C-N-CA 122.987 0.327 . . . . 71.22 112.657 176.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -79.4 101.49 8.17 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 122.912 0.485 . . . . 73.23 110.253 177.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.522 ' HB ' HH21 ' A' ' 56' ' ' ARG . 18.4 pt -90.93 104.6 15.58 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.354 0 CA-C-O 121.708 0.766 . . . . 62.55 110.954 -179.203 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 47.4 mt -73.18 -23.74 20.21 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 C-N-CA 123.92 0.888 . . . . 75.25 112.425 -172.736 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 69.7 mt -64.48 138.5 22.99 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.35 0 C-N-CA 123.177 0.591 . . . . 70.53 110.486 174.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.8 mp -63.94 100.62 0.32 Allowed 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.155 0.582 . . . . 73.31 112.059 -177.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . 0.459 ' CH2' ' HG3' ' A' ' 48' ' ' LYS . 96.8 m95 -125.03 121.31 33.99 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.58 0.752 . . . . 73.11 110.238 176.722 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 82.1 p -128.75 170.22 13.57 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 123.345 0.658 . . . . 72.1 111.304 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 39.5 ptt180 -52.76 -29.71 28.75 Favored 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 124.807 1.243 . . . . 73.15 113.576 -175.054 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.422 ' O ' HG23 ' A' ' 24' ' ' VAL . 18.3 m120 -77.87 -44.46 27.09 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 123.284 0.634 . . . . 75.31 111.714 177.677 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -59.5 -49.78 76.46 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 122.983 0.513 . . . . 64.11 111.582 -178.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.643 ' HB2' HD22 ' A' ' 60' ' ' LEU . 2.9 p30 -68.72 -32.45 72.26 Favored 'General case' 0 CA--C 1.558 1.282 0 CA-C-N 115.519 -0.764 . . . . 71.31 112.243 -177.769 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -63.85 -37.41 87.28 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 123.302 0.641 . . . . 75.44 111.296 173.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 20' ' ' ASN . 86.4 t -69.0 -38.03 77.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 C-N-CA 123.242 0.617 . . . . 75.43 111.298 176.338 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 81.9 mt -55.96 -57.49 8.15 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 C-N-CA 122.439 0.295 . . . . 74.25 110.243 173.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.521 ' HG ' HD12 ' A' ' 60' ' ' LEU . 96.0 mt -60.12 -36.52 77.66 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.638 0.775 . . . . 74.32 112.517 178.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 42.5 tp -59.61 -59.07 6.03 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.138 0.575 . . . . 72.22 110.701 -179.006 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -70.69 -25.54 63.02 Favored 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 123.338 0.655 . . . . 71.33 112.536 -179.552 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 90.4 m -73.66 -36.79 65.41 Favored 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 112.353 0.501 . . . . 61.42 112.353 178.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -81.5 -30.71 33.19 Favored 'General case' 0 N--CA 1.492 1.627 0 CA-C-O 121.378 0.609 . . . . 72.25 111.03 176.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -72.17 -46.66 55.44 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 125.147 1.379 . . . . 73.43 112.522 178.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 53.3 mtp180 -114.78 -25.08 8.39 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 123.91 0.884 . . . . 75.44 112.722 -170.353 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 108.65 129.13 5.87 Favored Glycine 0 N--CA 1.479 1.52 0 CA-C-O 118.915 -0.936 . . . . 54.22 111.879 -173.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -74.2 85.43 1.4 Allowed 'Trans proline' 0 C--N 1.377 2.053 0 C-N-CA 122.618 2.212 . . . . 75.41 112.684 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 18.0 t -141.19 -179.24 5.99 Favored 'General case' 0 N--CA 1.482 1.159 0 CA-C-N 115.42 -0.809 . . . . 75.45 110.496 178.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 84.0 p -58.8 -36.44 74.45 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 114.156 1.169 . . . . 74.41 114.156 -169.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -70.0 -27.49 64.74 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 123.004 0.522 . . . . 74.22 111.866 -178.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 70.4 m -85.66 -43.76 13.16 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.437 0.695 . . . . 63.05 109.987 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -67.84 -29.29 68.39 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.363 0.665 . . . . 75.11 112.051 178.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.19 -39.92 90.03 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 122.918 0.487 . . . . 75.5 111.211 173.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 66.8 t80 -65.41 -51.09 62.75 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 116.077 -0.511 . . . . 72.24 110.686 174.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 79.4 mt -59.64 -31.02 69.14 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 124.362 1.065 . . . . 75.35 112.56 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.71 -56.04 14.18 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.344 0.657 . . . . 72.15 111.022 172.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.82 -25.8 68.07 Favored 'General case' 0 CA--C 1.56 1.363 0 C-N-CA 123.655 0.782 . . . . 74.34 112.617 178.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -76.89 -52.11 10.04 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 124.124 0.97 . . . . 74.22 111.34 -177.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 51.4 mt -91.19 -2.42 57.51 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 124.082 0.953 . . . . 75.21 111.904 -176.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.5 t70 69.25 33.5 3.25 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 125.312 1.445 . . . . 72.23 111.425 -177.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.459 ' HG3' ' CH2' ' A' ' 17' ' ' TRP . 67.9 mmtt -105.33 -167.18 1.3 Allowed 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 124.489 1.116 . . . . 74.33 110.749 177.289 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -118.71 149.04 45.63 Favored Pre-proline 0 N--CA 1.489 1.523 0 C-N-CA 123.751 0.82 . . . . 72.4 109.996 171.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -51.36 -42.1 56.27 Favored 'Trans proline' 0 C--N 1.387 2.556 0 C-N-CA 123.689 2.926 . . . . 74.22 115.761 -172.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -65.27 -39.73 93.0 Favored 'General case' 0 N--CA 1.494 1.733 0 C-N-CA 122.621 0.368 . . . . 74.31 111.437 177.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.442 ' O ' ' HD3' ' A' ' 56' ' ' ARG . 79.7 mt-30 -65.79 -31.18 72.01 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.552 0.741 . . . . 72.04 111.234 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 95.7 t -74.89 -46.95 39.28 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.145 0 C-N-CA 123.517 0.727 . . . . 72.12 111.016 175.168 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 35.0 t -64.73 -36.13 83.3 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 124.103 0.961 . . . . 75.24 112.801 -174.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -71.94 -39.31 69.5 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 122.671 0.388 . . . . 72.43 111.874 177.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.522 HH21 ' HB ' ' A' ' 13' ' ' ILE . 5.7 mpt_? -69.53 -29.39 66.98 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 122.647 0.379 . . . . 74.34 111.026 176.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.503 ' HA ' HD13 ' A' ' 60' ' ' LEU . 8.2 t80 -55.37 -43.8 75.46 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.705 0.802 . . . . 75.44 111.019 168.661 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -74.75 -25.13 58.88 Favored 'General case' 0 CA--C 1.558 1.257 0 C-N-CA 123.47 0.708 . . . . 71.41 112.38 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -74.36 -31.85 62.55 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.346 0.593 . . . . 64.05 110.244 171.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.643 HD22 ' HB2' ' A' ' 22' ' ' ASP . 38.6 mt -65.83 -34.82 79.03 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.189 0.996 . . . . 72.24 111.482 172.621 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 33.8 mmt -62.72 -31.7 72.67 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.008 0.523 . . . . 74.11 111.564 175.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 58.3 mmtt -71.69 -29.92 65.11 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 112.695 0.628 . . . . 75.43 112.695 174.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.462 HD11 HD23 ' A' ' 60' ' ' LEU . 51.3 mt -62.46 -40.42 96.59 Favored 'General case' 0 N--CA 1.485 1.322 0 CA-C-O 121.076 0.465 . . . . 75.22 110.501 173.017 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 65.3 m-85 -76.64 -30.25 56.78 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 123.576 0.751 . . . . 74.44 112.36 176.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -66.91 -61.55 1.89 Allowed 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.396 0.678 . . . . 74.31 110.858 -176.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.652 ' HZ3' ' HB3' ' A' ' 66' ' ' LYS . 4.2 ttpm? -177.03 151.76 0.85 Allowed 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.21 0.604 . . . . 74.44 110.814 -173.384 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.414 ' HA ' HG13 ' A' ' 7' ' ' ILE . 49.0 m -71.52 141.17 50.13 Favored 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 109.969 -0.382 . . . . 73.14 109.969 166.03 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 59.7 mttm 72.76 155.18 0.16 Allowed 'General case' 0 N--CA 1.497 1.923 0 C-N-CA 125.071 1.349 . . . . 75.24 112.331 -177.079 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 44.2 t -67.26 -67.13 0.48 Allowed 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.469 0.708 . . . . 64.45 111.258 -178.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.565 1.539 0 C-N-CA 122.991 0.517 . . . . 72.32 111.786 176.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 45.6 m . . . . . 0 N--CA 1.495 1.784 0 N-CA-C 111.3 0.111 . . . . 73.24 111.3 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 63.6 m80 62.5 -154.58 0.34 Allowed 'General case' 0 N--CA 1.496 1.827 0 C-N-CA 124.281 1.032 . . . . 73.33 111.342 -178.163 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.461 ' HG3' HH22 ' A' ' 19' ' ' ARG . 38.5 tpp 65.45 88.41 0.11 Allowed 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 124.639 1.176 . . . . 73.21 111.417 177.159 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 35.6 ttmt -154.75 15.15 0.43 Allowed 'General case' 0 CA--C 1.563 1.452 0 C-N-CA 123.827 0.851 . . . . 71.14 110.293 -177.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 46.5 t-20 -72.09 92.65 1.34 Allowed 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 123.602 0.761 . . . . 72.04 110.871 -174.154 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 30.1 m -107.59 128.11 63.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 123.593 0.757 . . . . 73.34 110.449 176.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.3 mp -93.3 104.44 15.74 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.975 0 C-N-CA 123.548 0.739 . . . . 74.54 109.344 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 56.9 tptt 57.34 86.68 0.07 Allowed 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 124.286 1.034 . . . . 70.42 112.181 177.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -68.68 109.55 3.86 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-O 121.304 0.573 . . . . 74.23 111.584 -178.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -98.82 95.77 7.42 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.032 0.933 . . . . 70.2 110.013 177.464 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 151.28 76.13 0.02 OUTLIER Glycine 0 CA--C 1.531 1.087 0 CA-C-N 116.343 -0.39 . . . . 64.33 113.454 177.345 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -71.22 103.47 2.82 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 122.898 0.479 . . . . 73.01 110.247 170.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 4.3 pt -128.98 116.35 40.33 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.118 0 C-N-CA 124.09 0.956 . . . . 74.21 111.153 -175.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 14.9 tt -64.42 -18.45 23.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 C-N-CA 124.464 1.106 . . . . 73.41 112.777 -178.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.551 ' H ' HD12 ' A' ' 15' ' ' ILE . 3.6 mp -68.82 -19.98 24.5 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.58 0 C-N-CA 124.364 1.065 . . . . 75.13 111.727 -175.83 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 56.7 tp 63.71 75.03 0.4 Allowed 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 124.631 1.172 . . . . 74.22 111.153 -177.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 82.4 m95 -99.66 113.09 25.32 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 116.001 -0.545 . . . . 75.44 110.802 176.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 30.1 p -97.03 155.95 16.57 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 108.324 -0.991 . . . . 70.22 108.324 171.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.461 HH22 ' HG3' ' A' ' 3' ' ' MET . 35.3 ptt180 -58.93 -20.31 50.82 Favored 'General case' 0 CA--C 1.558 1.253 0 N-CA-C 112.237 0.458 . . . . 74.12 112.237 176.116 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -71.19 -40.49 71.19 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.969 0.908 . . . . 65.3 111.472 175.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.429 ' HA ' HD22 ' A' ' 46' ' ' LEU . 28.9 m-20 -60.54 -61.65 2.43 Favored 'General case' 0 N--CA 1.487 1.378 0 CA-C-O 121.49 0.662 . . . . 75.14 111.281 176.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.548 ' HB2' HD11 ' A' ' 60' ' ' LEU . 1.7 p30 -64.91 -28.67 69.69 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 113.624 0.972 . . . . 64.43 113.624 -174.231 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 28.2 tpt85 -56.21 -38.67 71.34 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 123.03 0.532 . . . . 74.11 111.921 173.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 44.0 t -72.9 -31.54 36.4 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 123.332 0.653 . . . . 73.35 111.184 177.059 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 66.0 mt -59.86 -47.19 92.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 C-N-CA 122.527 0.331 . . . . 65.11 110.34 172.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.406 HD22 ' HB3' ' A' ' 60' ' ' LEU . 97.4 mt -56.26 -38.96 71.86 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.741 0.817 . . . . 74.14 112.002 175.181 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 57.8 tp -63.81 -59.17 4.88 Favored 'General case' 0 CA--C 1.556 1.175 0 C-N-CA 123.419 0.688 . . . . 75.45 111.739 179.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -69.95 -22.15 63.2 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 113.236 0.828 . . . . 70.43 113.236 -175.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 65.7 m -69.8 -30.09 67.54 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 122.458 0.303 . . . . 63.34 111.415 173.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -84.19 -39.17 19.69 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 122.965 0.506 . . . . 75.32 111.026 174.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -61.44 -64.36 0.97 Allowed 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.975 0.91 . . . . 75.54 111.789 178.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.483 ' HD2' HG21 ' A' ' 38' ' ' THR . 37.5 mtt-85 -91.07 -52.19 4.96 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.74 0.816 . . . . 72.14 110.976 -174.368 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 131.08 147.1 5.97 Favored Glycine 0 CA--C 1.534 1.249 0 CA-C-N 115.157 -0.929 . . . . 72.4 111.391 -173.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -61.06 95.61 0.12 Allowed 'Trans proline' 0 C--N 1.374 1.869 0 C-N-CA 122.894 2.396 . . . . 73.42 112.445 175.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 48.3 t -146.95 157.06 43.52 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.985 0.914 . . . . 72.14 110.531 -175.588 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 81.0 p -65.34 -31.94 73.33 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.457 0.703 . . . . 73.53 112.407 -177.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -69.95 -26.66 64.22 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 123.286 0.634 . . . . 72.34 111.726 174.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.483 HG21 ' HD2' ' A' ' 32' ' ' ARG . 97.3 m -77.97 -42.99 31.01 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.759 0.823 . . . . 72.1 109.152 177.161 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -63.86 -28.81 70.1 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 124.028 0.931 . . . . 73.04 111.318 173.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.562 ' HA ' ' HG3' ' A' ' 50' ' ' PRO . . . -69.24 -42.35 75.75 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.372 0.669 . . . . 74.42 111.522 175.705 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -59.71 -49.41 77.84 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-O 121.077 0.465 . . . . 70.13 110.51 171.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 64.9 mt -63.74 -23.97 67.58 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.537 1.135 . . . . 74.23 112.741 178.495 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.77 -53.95 33.66 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.127 0.571 . . . . 73.45 110.727 172.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.27 -35.29 80.58 Favored 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 123.308 0.643 . . . . 75.43 111.635 177.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 58.2 tptt -66.93 -49.7 64.71 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.542 1.137 . . . . 75.42 111.693 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.429 HD22 ' HA ' ' A' ' 21' ' ' ASP . 64.9 mt -96.1 -2.15 47.14 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 113.013 0.746 . . . . 74.4 113.013 -172.715 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 79.88 -1.21 2.1 Favored 'General case' 0 N--CA 1.505 2.312 0 C-N-CA 126.117 1.767 . . . . 74.42 113.398 -178.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -88.88 -168.02 2.06 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 112.31 0.485 . . . . 71.31 112.31 -179.532 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -108.43 152.73 42.17 Favored Pre-proline 0 N--CA 1.484 1.248 0 C-N-CA 124.229 1.012 . . . . 75.04 110.126 173.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.562 ' HG3' ' HA ' ' A' ' 40' ' ' ALA . 37.4 Cg_exo -57.17 -34.17 97.26 Favored 'Trans proline' 0 C--N 1.39 2.72 0 C-N-CA 123.439 2.759 . . . . 74.21 114.203 -172.37 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.418 ' O ' ' HG3' ' A' ' 55' ' ' GLU . 18.3 m120 -67.78 -39.75 84.06 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.372 0.669 . . . . 65.24 111.497 177.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -66.33 -42.22 88.49 Favored 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 123.225 0.61 . . . . 73.52 110.453 177.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 82.0 t -57.58 -41.15 78.47 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 124.314 1.046 . . . . 65.05 111.049 173.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.506 ' O ' ' HG3' ' A' ' 58' ' ' GLN . 34.3 t -65.59 -41.25 93.05 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.152 0.581 . . . . 70.53 111.503 178.422 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.418 ' HG3' ' O ' ' A' ' 51' ' ' ASN . 52.0 mt-10 -57.98 -49.55 76.44 Favored 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 123.049 0.54 . . . . 61.24 111.142 176.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.4 tpm_? -62.16 -39.1 91.5 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 124.169 0.988 . . . . 71.51 111.818 176.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.416 ' HA ' HD13 ' A' ' 60' ' ' LEU . 16.0 t80 -56.14 -49.77 73.01 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 124.59 1.156 . . . . 71.02 112.252 177.288 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.506 ' HG3' ' O ' ' A' ' 54' ' ' SER . 62.3 mt-30 -68.59 -25.83 65.07 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.479 0.711 . . . . 73.11 111.439 -176.391 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 71.2 mt-30 -71.31 -47.73 54.96 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 115.427 -0.806 . . . . 75.43 109.668 171.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.548 HD11 ' HB2' ' A' ' 22' ' ' ASP . 58.2 mt -52.93 -46.65 68.2 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 124.497 1.119 . . . . 63.33 112.603 178.34 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 33.9 mmt -56.43 -48.48 76.91 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.102 0.561 . . . . 75.03 111.822 -179.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 85.4 tttt -75.55 -35.6 60.63 Favored 'General case' 0 CA--C 1.559 1.312 0 N-CA-C 112.783 0.66 . . . . 74.03 112.783 -176.276 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 97.1 mt -73.07 -38.18 66.54 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 123.258 0.623 . . . . 75.33 111.554 179.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -72.19 -36.43 69.22 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.466 0.706 . . . . 75.32 110.538 179.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -69.85 -37.12 76.04 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.04 0.936 . . . . 74.23 111.308 173.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 84.3 tttt 74.29 -29.06 0.19 Allowed 'General case' 0 CA--C 1.566 1.595 0 C-N-CA 125.787 1.635 . . . . 71.54 114.045 177.182 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 88.2 p -64.62 149.21 49.35 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 113.045 0.758 . . . . 74.14 113.045 -172.176 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.531 ' HG2' ' H ' ' A' ' 69' ' ' CYS . 73.2 tttt -108.84 -151.5 0.47 Allowed 'General case' 0 CA--C 1.568 1.665 0 C-N-CA 123.933 0.893 . . . . 74.02 109.298 -177.569 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.531 ' H ' ' HG2' ' A' ' 68' ' ' LYS . 62.4 m 73.18 -15.74 0.52 Allowed 'General case' 0 N--CA 1.501 2.076 0 C-N-CA 125.1 1.36 . . . . 51.45 113.737 178.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 21.1 mtm180 . . . . . 0 CA--C 1.565 1.55 0 C-N-CA 124.125 0.97 . . . . 74.23 110.042 179.905 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 33.2 m . . . . . 0 N--CA 1.486 1.359 0 N-CA-C 110.706 -0.109 . . . . 71.22 110.706 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 85.1 m-70 -136.53 137.06 39.89 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.461 0.704 . . . . 73.5 111.009 177.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 22.9 ptp -134.08 145.2 49.15 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 123.49 0.716 . . . . 72.21 110.598 177.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -79.67 96.77 6.3 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.28 0.632 . . . . 72.41 110.121 178.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -81.29 70.98 8.26 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-O 121.721 0.772 . . . . 74.44 111.271 -179.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 10.2 m -84.63 102.29 10.37 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 CA-C-N 115.493 -0.776 . . . . 73.2 109.824 177.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 34.1 pt -77.5 -27.72 15.76 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 C-N-CA 123.815 0.846 . . . . 72.21 113.019 -168.527 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.577 ' HG3' ' HB3' ' A' ' 63' ' ' LEU . 42.9 mmtm 69.75 140.87 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 125.263 1.425 . . . . 74.34 113.261 -173.357 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -65.01 114.49 4.61 Favored 'General case' 0 CA--C 1.552 1.045 0 CA-C-N 115.223 -0.899 . . . . 73.05 109.539 168.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.504 ' HA ' ' HE3' ' A' ' 10' ' ' LYS . 0.0 OUTLIER -66.83 124.14 22.11 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.316 0.646 . . . . 73.4 111.544 -179.077 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -68.63 165.53 47.46 Favored Glycine 0 CA--C 1.534 1.281 0 CA-C-N 116.428 -0.351 . . . . 71.34 112.556 170.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -68.48 95.6 0.64 Allowed 'General case' 0 N--CA 1.481 1.093 0 CA-C-O 121.513 0.673 . . . . 72.23 111.284 -178.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.504 HG22 ' H ' ' A' ' 15' ' ' ILE . 41.3 mm -107.98 131.89 57.13 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.99 0 CA-C-N 115.47 -0.787 . . . . 73.45 109.202 175.834 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 41.5 pt -82.63 -6.43 10.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 C-N-CA 123.308 0.643 . . . . 64.53 112.585 -176.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.504 ' H ' HG22 ' A' ' 13' ' ' ILE . 56.0 mt -110.76 146.92 15.27 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 C-N-CA 123.675 0.79 . . . . 70.34 111.013 -178.629 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 63.0 tp -62.09 104.66 0.49 Allowed 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 124.426 1.09 . . . . 74.12 111.171 175.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 95.4 m95 -131.28 120.56 23.36 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.823 0.849 . . . . 75.44 110.025 176.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 27.1 p -106.03 166.88 10.18 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.2 0.6 . . . . 74.22 109.845 179.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.47 -20.77 66.39 Favored 'General case' 0 CA--C 1.552 1.048 0 CA-C-N 115.923 -0.58 . . . . 74.13 112.461 175.784 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -73.13 -43.33 61.78 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.651 0.78 . . . . 65.15 110.66 173.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -57.84 -44.95 86.82 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.893 0.477 . . . . 74.13 110.848 171.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 -56.64 -53.13 61.19 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 124.111 0.964 . . . . 73.21 111.511 176.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 19.8 tpp180 -55.64 -47.76 76.11 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.911 0.884 . . . . 75.15 111.636 179.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 82.2 t -66.64 -43.7 90.2 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.152 0 C-N-CA 122.936 0.494 . . . . 72.42 112.137 -177.438 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 73.4 mt -56.79 -53.01 47.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 CA-C-N 118.324 0.511 . . . . 74.44 111.18 175.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.434 HD13 HD21 ' A' ' 60' ' ' LEU . 73.3 mt -61.25 -37.49 83.28 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 123.789 0.836 . . . . 74.41 112.231 -179.53 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 36.2 tp -73.78 -58.15 3.5 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.336 0.654 . . . . 73.14 111.734 -176.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.595 ' HB2' HD22 ' A' ' 42' ' ' LEU . 4.2 mm-40 -66.89 -23.51 66.01 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.141 0.576 . . . . 74.13 112.1 -175.286 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 99.2 m -70.77 -29.92 66.26 Favored 'General case' 0 N--CA 1.493 1.715 0 C-N-CA 122.932 0.493 . . . . 73.23 111.742 172.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -77.58 -25.89 50.34 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.874 -0.517 . . . . 74.34 111.438 172.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.1 mpmm? -76.17 -62.74 1.51 Allowed 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.59 0.756 . . . . 73.32 111.633 178.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 7.4 mpt_? -93.13 -2.73 55.09 Favored 'General case' 0 N--CA 1.49 1.525 0 N-CA-C 112.826 0.676 . . . . 74.41 112.826 -174.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.73 146.22 18.6 Favored Glycine 0 N--CA 1.487 2.041 0 CA-C-O 119.095 -0.836 . . . . 65.3 112.602 -173.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -77.49 43.05 1.25 Allowed 'Trans proline' 0 C--N 1.376 1.991 0 C-N-CA 123.373 2.715 . . . . 71.32 113.543 -177.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 42.6 m -97.35 168.68 10.26 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.18 0.992 . . . . 71.21 111.543 -177.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' SER . . . . . 0.425 ' HA ' ' HD2' ' A' ' 39' ' ' PHE . 89.9 p -61.1 -30.87 70.62 Favored 'General case' 0 N--CA 1.499 1.99 0 C-N-CA 123.35 0.66 . . . . 75.2 112.26 179.282 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 62.3 tttm -58.45 -28.24 65.11 Favored 'General case' 0 CA--C 1.559 1.318 0 C-N-CA 124.392 1.077 . . . . 71.31 112.165 175.252 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 59.4 m -93.26 -34.23 13.64 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.524 0.73 . . . . 73.33 110.959 -178.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . 0.425 ' HD2' ' HA ' ' A' ' 36' ' ' SER . 33.8 m-85 -62.54 -33.69 75.43 Favored 'General case' 0 N--CA 1.489 1.518 0 CA-C-O 121.153 0.501 . . . . 74.52 111.418 174.271 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.16 -41.36 94.78 Favored 'General case' 0 CA--C 1.557 1.234 0 C-N-CA 123.693 0.797 . . . . 73.22 111.493 173.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 77.0 t80 -62.34 -52.33 64.09 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.825 0.85 . . . . 72.51 111.209 174.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.595 HD22 ' HB2' ' A' ' 28' ' ' GLU . 80.7 mt -60.24 -31.37 70.13 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 125.094 1.357 . . . . 75.33 113.031 -178.764 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.37 -53.37 58.4 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.326 0.65 . . . . 72.23 111.639 175.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.56 -27.76 62.41 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 122.859 0.463 . . . . 53.32 111.968 177.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -72.66 -30.51 64.34 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 124.153 0.981 . . . . 74.21 111.787 -178.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 97.0 mt -116.33 4.66 13.46 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.618 0.767 . . . . 72.41 112.427 -177.36 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 61.34 27.53 17.16 Favored 'General case' 0 N--CA 1.497 1.9 0 C-N-CA 124.231 1.013 . . . . 74.5 112.594 -176.699 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -102.54 -174.67 2.62 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.369 1.067 . . . . 74.24 111.132 179.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -107.71 140.66 21.79 Favored Pre-proline 0 N--CA 1.486 1.353 0 C-N-CA 123.656 0.782 . . . . 74.2 109.402 175.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -56.43 -34.58 94.91 Favored 'Trans proline' 0 C--N 1.387 2.569 0 C-N-CA 123.105 2.536 . . . . 62.23 113.644 -172.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -60.35 -48.05 83.42 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.183 0.993 . . . . 73.52 111.024 175.12 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -72.97 -30.24 63.67 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.687 0.795 . . . . 73.23 111.681 -177.041 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 71.4 t -65.52 -44.03 94.14 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 123.292 0.637 . . . . 75.04 110.55 173.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 44.1 t -64.57 -42.97 95.29 Favored 'General case' 0 N--CA 1.485 1.302 0 CA-C-N 115.952 -0.567 . . . . 75.44 111.265 177.123 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -60.73 -44.47 96.6 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 123.576 0.751 . . . . 72.43 111.944 175.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 16.3 tpt180 -68.57 -39.15 81.12 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 122.642 0.377 . . . . 75.41 111.201 179.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -58.44 -53.03 62.97 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 124.063 0.945 . . . . 73.35 111.631 179.111 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.449 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 66.6 mt-30 -73.04 -26.7 61.39 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-N 115.324 -0.853 . . . . 73.31 111.226 -176.243 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 12.3 tm0? -69.7 -41.59 75.18 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 123.6 0.76 . . . . 72.21 109.366 173.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.434 HD21 HD13 ' A' ' 26' ' ' LEU . 13.0 mt -56.15 -48.13 76.87 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 124.355 1.062 . . . . 74.53 110.895 172.556 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.431 ' HA ' ' HE2' ' A' ' 61' ' ' MET . 29.2 mmt -55.3 -46.35 76.24 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.235 0.614 . . . . 74.2 111.22 176.382 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.449 ' HG2' ' O ' ' A' ' 58' ' ' GLN . 34.8 mmtp -58.55 -39.38 80.05 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 123.524 0.73 . . . . 73.02 112.316 177.155 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.577 ' HB3' ' HG3' ' A' ' 8' ' ' LYS . 97.6 mt -61.14 -52.83 63.21 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.142 0.577 . . . . 74.12 111.047 176.419 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -62.79 -29.66 70.87 Favored 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 123.047 0.539 . . . . 65.43 112.403 -179.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -68.91 -59.22 3.21 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 122.972 0.509 . . . . 72.41 110.924 174.498 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.569 ' HG2' ' H ' ' A' ' 68' ' ' LYS . 39.9 ttmt -175.62 140.16 0.45 Allowed 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.442 0.697 . . . . 74.34 110.853 -179.307 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 81.7 p -70.93 -26.27 63.12 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.609 0.764 . . . . 62.42 112.048 176.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.569 ' H ' ' HG2' ' A' ' 66' ' ' LYS . 67.3 mttm 66.48 -177.24 0.19 Allowed 'General case' 0 N--CA 1.496 1.865 0 C-N-CA 124.869 1.268 . . . . 74.03 111.949 -178.187 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 46.4 t 61.64 20.1 11.02 Favored 'General case' 0 N--CA 1.496 1.861 0 C-N-CA 124.163 0.985 . . . . 73.22 113.571 171.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 41.4 ttt-85 . . . . . 0 CA--C 1.565 1.549 0 C-N-CA 123.336 0.654 . . . . 74.34 111.52 -174.522 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 76.4 p . . . . . 0 N--CA 1.498 1.925 0 N-CA-C 111.182 0.067 . . . . 54.14 111.182 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 38.0 m80 -63.76 -59.69 4.24 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.191 0.597 . . . . 73.1 111.127 176.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 53.5 mtm 61.56 -176.21 0.12 Allowed 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 124.282 1.033 . . . . 73.53 112.836 177.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -158.73 88.59 0.92 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 123.42 0.688 . . . . 73.22 109.213 174.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -120.4 18.74 12.13 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-O 122.151 0.977 . . . . 70.14 109.638 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 33.5 m -93.51 20.98 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 C-N-CA 124.322 1.049 . . . . 75.14 112.11 -175.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.0 mp -74.21 92.4 0.68 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.2 0 C-N-CA 123.448 0.699 . . . . 73.11 110.765 -172.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -170.32 163.4 8.74 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 124.849 1.26 . . . . 73.42 110.696 177.361 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.4 tmtt? -139.22 64.97 1.45 Allowed 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 109.086 -0.709 . . . . 74.42 109.086 176.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -176.1 149.11 0.86 Allowed 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 124.25 1.02 . . . . 73.44 109.83 178.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 78.94 91.86 0.36 Allowed Glycine 0 C--N 1.346 1.118 0 N-CA-C 112.466 -0.254 . . . . 71.13 112.466 -178.117 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -77.81 12.04 1.89 Allowed 'General case' 0 CA--C 1.561 1.383 0 C-N-CA 124.108 0.963 . . . . 65.42 113.147 -171.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.4 mp -69.08 122.73 21.08 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 C-N-CA 123.412 0.685 . . . . 73.52 109.586 175.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 30.6 pt -76.76 -8.71 11.94 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 N-CA-C 113.759 1.022 . . . . 74.33 113.759 -170.686 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 65.9 mt -98.93 118.12 45.03 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 C-N-CA 123.329 0.652 . . . . 75.23 110.463 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.8 tp -83.09 115.94 22.1 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.393 0.677 . . . . 64.33 111.038 178.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . 0.676 ' HZ2' ' HB3' ' A' ' 52' ' ' GLN . 81.6 m95 -104.18 112.32 25.29 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.891 0.876 . . . . 74.41 109.89 172.182 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 43.9 p -96.67 161.52 13.84 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 122.814 0.446 . . . . 63.52 110.834 -178.177 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 35.0 ptt180 -57.65 -23.26 50.33 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.527 0.731 . . . . 74.51 111.904 171.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -69.69 -46.24 66.47 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 123.905 0.882 . . . . 75.44 110.73 175.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.4 m-20 -58.61 -47.09 85.52 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.017 0.527 . . . . 72.22 111.234 174.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.405 ' HB3' HD22 ' A' ' 60' ' ' LEU . 56.5 m-20 -55.94 -47.16 78.07 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.157 0.983 . . . . 75.25 112.254 176.844 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 32.3 ttm180 -61.57 -40.22 93.98 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.915 0.486 . . . . 72.51 112.016 179.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 85.4 t -69.27 -40.0 79.75 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 122.73 0.412 . . . . 72.45 111.643 178.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 81.3 mt -58.88 -43.58 88.75 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 CA-C-O 120.877 0.37 . . . . 72.23 110.991 175.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 88.5 mt -70.94 -35.04 72.04 Favored 'General case' 0 CA--C 1.555 1.149 0 C-N-CA 123.287 0.635 . . . . 73.53 111.694 176.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 31.0 tp -67.27 -52.0 46.11 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.862 0.865 . . . . 71.34 111.719 -176.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -74.42 -20.49 60.03 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.123 0.569 . . . . 65.15 111.684 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 53.4 t -72.08 -34.7 68.89 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 122.85 0.46 . . . . 75.04 111.174 171.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -79.74 -15.61 57.18 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.158 0.583 . . . . 72.53 111.423 172.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 56.2 tptt -80.78 -48.38 12.56 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 123.694 0.798 . . . . 73.34 110.94 175.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 50.6 mtt180 -106.46 -63.58 1.26 Allowed 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.737 0.815 . . . . 75.43 111.447 -178.537 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 136.7 154.1 6.66 Favored Glycine 0 CA--C 1.539 1.544 0 CA-C-O 119.086 -0.841 . . . . 71.12 111.694 -172.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_exo -57.68 109.08 0.43 Allowed 'Trans proline' 0 C--N 1.374 1.88 0 C-N-CA 123.128 2.552 . . . . 73.43 113.168 176.319 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 46.7 t -156.39 155.37 32.03 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.316 0.646 . . . . 71.43 111.371 -177.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 58.4 p -62.91 -33.47 75.4 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.547 0.739 . . . . 74.44 111.23 172.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -63.96 -33.85 76.65 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.516 0.726 . . . . 73.35 111.124 173.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 38.4 m -83.36 -27.98 29.29 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 123.276 0.63 . . . . 63.42 110.192 -176.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 22.5 m-30 -69.35 -36.29 76.73 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.242 0.617 . . . . 71.5 110.849 172.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.02 -39.84 87.12 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 123.451 0.7 . . . . 73.2 110.924 173.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -65.54 -39.52 91.84 Favored 'General case' 0 CA--C 1.557 1.242 0 C-N-CA 124.425 1.09 . . . . 73.12 111.876 176.304 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.445 ' HB2' HG12 ' A' ' 53' ' ' VAL . 39.5 mt -73.41 -29.28 62.49 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 124.168 0.987 . . . . 72.14 112.248 175.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.47 -39.18 93.77 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 122.867 0.467 . . . . 64.21 110.385 171.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -71.36 -43.27 67.24 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 123.52 0.728 . . . . 63.54 112.001 175.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -70.05 -39.91 75.41 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.937 0.895 . . . . 71.14 112.09 -172.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 91.9 mt -100.26 -3.48 31.33 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.601 0.761 . . . . 75.43 112.962 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 60.15 25.01 14.32 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 124.246 1.018 . . . . 72.44 112.311 -177.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 48.6 mmtm -94.43 171.9 8.53 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 124.197 0.999 . . . . 72.23 110.291 177.324 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 37.4 m-80 -75.62 145.05 78.17 Favored Pre-proline 0 N--CA 1.486 1.333 0 CA-C-O 118.944 -0.55 . . . . 74.32 110.127 174.359 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -60.42 -28.83 87.49 Favored 'Trans proline' 0 C--N 1.381 2.252 0 C-N-CA 122.443 2.096 . . . . 73.32 112.503 178.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -72.27 -39.53 68.3 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.283 1.033 . . . . 74.13 110.629 177.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.676 ' HB3' ' HZ2' ' A' ' 17' ' ' TRP . 24.3 mm-40 -63.73 -38.27 90.49 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.603 0.761 . . . . 75.51 111.906 173.419 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.445 HG12 ' HB2' ' A' ' 42' ' ' LEU . 69.6 t -69.64 -48.88 63.0 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 C-N-CA 123.268 0.627 . . . . 74.4 111.877 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 79.9 p -58.04 -42.72 86.0 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 123.117 0.567 . . . . 71.32 111.48 179.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -61.83 -52.58 63.58 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.989 0.516 . . . . 71.11 112.203 173.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 28.4 tpt180 -65.25 -31.3 72.39 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 122.896 0.479 . . . . 73.43 112.108 -174.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -57.27 -52.28 65.95 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.869 0.868 . . . . 73.41 110.847 171.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -73.77 -23.36 59.71 Favored 'General case' 0 CA--C 1.552 1.035 0 CA-C-N 115.472 -0.786 . . . . 64.04 112.219 -176.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.442 ' O ' ' HG ' ' A' ' 63' ' ' LEU . 36.1 mm-40 -65.86 -46.94 76.6 Favored 'General case' 0 N--CA 1.484 1.259 0 N-CA-C 109.469 -0.567 . . . . 74.52 109.469 168.779 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.405 HD22 ' HB3' ' A' ' 22' ' ' ASP . 21.6 mt -58.62 -45.22 89.68 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.298 1.039 . . . . 72.44 112.304 175.77 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 36.0 mmt -59.96 -36.18 76.54 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 121.261 0.553 . . . . 74.21 111.295 177.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 17.3 tptp -68.96 -32.13 71.49 Favored 'General case' 0 CA--C 1.561 1.369 0 C-N-CA 123.858 0.863 . . . . 74.14 110.919 177.32 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 59' ' ' GLN . 70.9 mt -75.87 -30.59 58.93 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.767 0.827 . . . . 75.13 111.884 177.722 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -62.62 -29.03 70.31 Favored 'General case' 0 N--CA 1.495 1.792 0 C-N-CA 122.875 0.47 . . . . 74.1 111.67 172.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -65.71 -59.36 3.99 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.01 0.524 . . . . 75.22 109.819 170.161 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -172.28 125.54 0.52 Allowed 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.027 0.931 . . . . 74.34 109.987 179.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 64.0 m -83.23 85.75 7.15 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-O 121.381 0.61 . . . . 65.24 109.998 175.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 45.0 tttm -96.33 137.11 35.89 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.612 1.165 . . . . 74.4 110.474 179.119 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 51.0 t 66.11 -66.93 0.16 Allowed 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 125.134 1.374 . . . . 71.31 111.2 -169.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 29.8 mmm180 . . . . . 0 CA--C 1.563 1.469 0 C-N-CA 123.464 0.705 . . . . 71.54 109.981 173.121 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 64.8 p . . . . . 0 N--CA 1.488 1.465 0 CA-C-O 120.569 0.223 . . . . 73.02 110.765 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 84.2 m-70 -139.23 -57.42 0.6 Allowed 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 124.007 0.923 . . . . 75.32 110.414 175.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' MET . . . . . 0.486 ' HG2' ' H ' ' A' ' 4' ' ' LYS . 31.2 ttm 60.23 -174.44 0.11 Allowed 'General case' 0 CA--C 1.572 1.797 0 C-N-CA 124.385 1.074 . . . . 75.54 110.638 -174.335 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.533 ' HZ2' ' HB2' ' A' ' 4' ' ' LYS . 4.6 ttmp? 69.63 -1.17 2.36 Favored 'General case' 0 N--CA 1.503 2.181 0 N-CA-C 113.605 0.965 . . . . 72.52 113.605 167.677 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -77.86 174.74 10.7 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.63 0.772 . . . . 73.33 111.93 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 40.5 t 61.92 75.44 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 C-N-CA 124.48 1.112 . . . . 73.33 109.549 -168.286 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.0 mp -77.96 102.11 4.1 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.923 0 CA-C-N 115.12 -0.945 . . . . 73.11 109.611 -173.591 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -123.65 138.48 54.53 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.632 0.773 . . . . 74.51 110.314 177.625 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 44.6 pttt -151.76 159.03 44.09 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 124.635 1.174 . . . . 74.13 109.771 -176.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 48.6 mtmt 65.76 -170.32 0.2 Allowed 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 124.748 1.219 . . . . 73.02 111.819 -170.204 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 123.12 169.58 13.31 Favored Glycine 0 N--CA 1.475 1.269 0 CA-C-N 116.425 -0.352 . . . . 72.14 112.849 177.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.473 ' HG3' ' HG3' ' A' ' 70' ' ' ARG . 34.6 mm-40 -87.67 96.91 10.6 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 123.059 0.544 . . . . 74.14 112.083 -178.464 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.3 mp -118.28 122.36 69.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 N-CA-C 108.496 -0.927 . . . . 74.33 108.496 169.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 37.8 pt -81.0 -22.63 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 C-N-CA 122.964 0.506 . . . . 73.21 112.09 179.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 29.1 mt -95.2 156.69 3.17 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.353 0 C-N-CA 124.378 1.071 . . . . 71.5 109.661 177.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 33.8 tp -78.41 91.16 4.46 Favored 'General case' 0 CA--C 1.562 1.43 0 O-C-N 121.692 -0.63 . . . . 74.12 110.705 175.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 89.6 m95 -117.84 146.33 43.95 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 124.732 1.213 . . . . 75.15 110.061 175.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 15.8 p -101.59 165.78 11.05 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 109.902 -0.407 . . . . 71.54 109.902 173.068 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 20.2 ptp180 -66.55 -21.37 66.15 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.211 0.604 . . . . 75.22 111.281 177.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -75.58 -50.67 14.87 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.167 0.987 . . . . 74.43 110.097 179.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 52.7 m-20 -63.59 -42.31 98.28 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.132 0.573 . . . . 74.04 110.606 177.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -53.87 -50.42 66.31 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 125.034 1.334 . . . . 73.22 111.281 176.115 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.6 -29.14 65.47 Favored 'General case' 0 CA--C 1.558 1.257 0 CA-C-N 115.305 -0.861 . . . . 74.23 112.014 -178.724 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 53.7 t -68.93 -40.88 81.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 C-N-CA 122.717 0.407 . . . . 61.24 110.952 173.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 86.8 mt -56.99 -59.42 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.364 0 O-C-N 123.306 0.378 . . . . 73.02 110.288 175.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.548 HD13 HD21 ' A' ' 60' ' ' LEU . 83.9 mt -59.8 -34.1 72.59 Favored 'General case' 0 N--CA 1.485 1.302 0 N-CA-C 112.833 0.679 . . . . 71.41 112.833 -176.486 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 37.6 tp -75.93 -57.0 4.13 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.135 0.574 . . . . 75.42 112.255 -175.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.731 ' HB2' HD23 ' A' ' 42' ' ' LEU . 24.5 mt-10 -77.75 -18.81 56.1 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 112.893 0.701 . . . . 75.41 112.893 -176.49 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . 0.543 ' SG ' ' HA ' ' A' ' 34' ' ' PRO . 43.1 t -70.9 -51.01 28.8 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.635 0.374 . . . . 75.4 110.922 176.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -66.87 -27.91 67.91 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 122.863 0.465 . . . . 71.52 111.61 174.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 59.9 tptt -65.05 -50.08 67.61 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.814 0.845 . . . . 72.51 111.057 176.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 61.3 mtp85 -100.6 11.67 39.0 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 112.766 0.654 . . . . 74.41 112.766 -175.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 79.51 110.8 0.24 Allowed Glycine 0 CA--C 1.544 1.892 0 CA-C-O 118.762 -1.021 . . . . 72.13 112.377 178.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.543 ' HA ' ' SG ' ' A' ' 29' ' ' CYS . 20.1 Cg_endo -57.53 99.34 0.09 OUTLIER 'Trans proline' 0 C--N 1.382 2.32 0 C-N-CA 123.373 2.716 . . . . 62.43 113.691 -173.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 23.0 t -157.37 174.22 15.74 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.224 0.609 . . . . 74.23 112.004 -172.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 60.5 p -55.5 -50.33 70.22 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 124.78 1.232 . . . . 73.14 113.689 -175.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 26.5 mtpp -69.22 -15.13 63.31 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 112.9 0.704 . . . . 72.21 112.9 -178.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 27.5 m -87.31 -34.06 19.0 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.469 0.708 . . . . 60.34 109.693 177.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -66.67 -35.67 80.7 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.212 0.605 . . . . 73.2 110.847 173.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.41 -36.55 83.11 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.455 0.702 . . . . 61.51 111.775 175.226 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -63.24 -55.66 23.05 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.376 0.67 . . . . 71.23 111.216 172.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.731 HD23 ' HB2' ' A' ' 28' ' ' GLU . 81.2 mt -62.17 -23.25 66.48 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 124.177 0.991 . . . . 75.05 112.616 178.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.3 -57.7 8.63 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.347 0.659 . . . . 73.21 111.32 173.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.9 -30.67 71.3 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-N 115.876 -0.602 . . . . 75.05 111.666 178.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.411 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 0.5 OUTLIER -68.28 -42.87 78.89 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 123.703 0.801 . . . . 75.24 111.78 177.801 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 89.8 mt -104.25 12.85 33.2 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 123.485 0.714 . . . . 74.22 112.831 -175.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.2 t70 64.18 16.09 9.8 Favored 'General case' 0 CA--C 1.575 1.911 0 C-N-CA 124.064 0.946 . . . . 74.32 112.558 175.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -107.83 -175.11 2.69 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.777 0.831 . . . . 75.15 112.008 -178.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -91.65 150.98 41.93 Favored Pre-proline 0 N--CA 1.484 1.236 0 C-N-CA 123.302 0.641 . . . . 73.21 110.145 176.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 79.1 Cg_exo -52.59 -35.41 67.18 Favored 'Trans proline' 0 C--N 1.384 2.402 0 C-N-CA 122.857 2.371 . . . . 64.54 113.618 174.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -64.46 -46.9 81.13 Favored 'General case' 0 CA--C 1.557 1.248 0 C-N-CA 123.172 0.589 . . . . 73.31 110.43 176.379 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -54.78 -46.84 74.47 Favored 'General case' 0 N--CA 1.499 1.977 0 C-N-CA 123.743 0.817 . . . . 75.22 112.008 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.516 HG11 ' HB2' ' A' ' 42' ' ' LEU . 69.4 t -65.7 -45.41 92.06 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 CA-C-N 115.286 -0.87 . . . . 75.35 111.183 179.728 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' SER . . . . . 0.458 ' O ' ' HG3' ' A' ' 58' ' ' GLN . 35.0 t -58.09 -43.39 87.06 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.344 0.658 . . . . 74.15 111.6 177.286 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -62.09 -53.91 48.71 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.511 0.725 . . . . 73.2 111.64 178.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.403 ' HA ' ' HD2' ' A' ' 56' ' ' ARG . 10.7 tpt180 -61.59 -38.49 87.76 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 122.683 0.393 . . . . 75.42 111.621 -178.704 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -55.46 -52.62 63.02 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.853 0.861 . . . . 74.54 112.134 174.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.458 ' HG3' ' O ' ' A' ' 54' ' ' SER . 83.3 mt-30 -73.59 -24.39 60.06 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.326 0.65 . . . . 75.5 112.136 -175.493 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.445 ' O ' ' HG ' ' A' ' 63' ' ' LEU . 19.1 mm-40 -68.3 -43.61 77.29 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 122.998 0.519 . . . . 63.23 109.641 170.113 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.548 HD21 HD13 ' A' ' 26' ' ' LEU . 14.3 mt -60.59 -45.55 93.53 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.285 1.034 . . . . 74.31 112.262 176.057 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 35.1 mmt -57.81 -43.73 85.87 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.364 0.666 . . . . 74.51 110.768 175.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.474 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 0.2 OUTLIER -64.88 -31.58 72.87 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 123.893 0.877 . . . . 74.22 111.841 178.222 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' A' ' 59' ' ' GLN . 97.6 mt -72.93 -35.9 67.12 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.295 0.638 . . . . 75.11 111.717 175.734 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 47.4 m-85 -65.29 -27.56 68.71 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-O 120.865 0.364 . . . . 73.41 111.232 173.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -80.18 -41.55 25.07 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.643 0.777 . . . . 75.54 111.396 173.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -165.13 110.61 0.92 Allowed 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 124.121 0.968 . . . . 62.15 110.956 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 16.4 t -123.48 24.72 8.52 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.95 0.9 . . . . 70.34 111.21 178.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -58.61 -42.8 89.0 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 123.079 0.552 . . . . 64.3 111.523 177.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . 0.438 ' SG ' ' HD2' ' A' ' 70' ' ' ARG . 42.6 t -149.59 -78.4 0.14 Allowed 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.688 0.795 . . . . 62.32 109.09 175.074 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.473 ' HG3' ' HG3' ' A' ' 12' ' ' GLU . 4.6 mpt_? . . . . . 0 C--O 1.26 1.609 0 N-CA-C 108.502 -0.925 . . . . 74.15 108.502 165.009 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 64.0 p . . . . . 0 N--CA 1.489 1.482 0 CA-C-O 120.769 0.318 . . . . 65.14 111.145 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -107.79 -25.64 11.16 Favored 'General case' 0 CA--C 1.56 1.33 0 C-N-CA 124.017 0.927 . . . . 74.34 110.079 175.826 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 24.5 ptp -63.13 160.22 15.83 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 124.003 0.921 . . . . 63.51 112.985 -179.761 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -156.35 -174.38 4.92 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.479 0.712 . . . . 71.04 110.611 -179.074 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -116.59 139.61 50.31 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 123.826 0.85 . . . . 74.11 109.645 165.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.6 p -94.14 -32.15 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 C-N-CA 122.888 0.475 . . . . 62.1 111.589 179.182 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 44.2 mm 59.07 92.89 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.326 0 C-N-CA 125.163 1.385 . . . . 71.02 112.649 -178.485 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 59.8 mttp -123.78 113.65 18.85 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.577 0.751 . . . . 64.44 109.532 168.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -149.03 161.13 42.55 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.372 0.669 . . . . 75.05 110.565 176.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 45.2 tptt 61.95 30.07 17.96 Favored 'General case' 0 CA--C 1.566 1.582 0 C-N-CA 124.2 1.0 . . . . 73.14 111.704 178.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -78.13 61.49 3.79 Favored Glycine 0 C--N 1.354 1.57 0 CA-C-N 115.926 -0.579 . . . . 74.33 111.893 172.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -90.21 17.11 7.44 Favored 'General case' 0 CA--C 1.564 1.513 0 C-N-CA 124.805 1.242 . . . . 75.41 111.606 -169.702 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.9 pp -64.51 145.65 13.72 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.261 0 C-N-CA 123.752 0.821 . . . . 74.22 112.242 175.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 16.4 tt -74.07 -16.89 16.95 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 C-N-CA 123.835 0.854 . . . . 72.5 112.286 -176.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 19.2 mt -76.96 143.01 13.51 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.062 0 C-N-CA 124.027 0.931 . . . . 74.44 110.839 -177.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.7 tt -75.54 115.33 15.09 Favored 'General case' 0 CA--C 1.558 1.282 0 C-N-CA 123.414 0.686 . . . . 74.43 109.792 178.141 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . 0.548 ' HZ3' HD12 ' A' ' 46' ' ' LEU . 98.6 m95 -140.56 145.68 37.07 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 124.657 1.183 . . . . 75.33 110.414 176.213 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 18.0 p -122.2 158.16 30.02 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 109.259 -0.645 . . . . 71.12 109.259 170.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.6 ptp180 -63.24 -19.04 64.19 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 123.562 0.745 . . . . 74.01 112.673 176.541 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.446 ' O ' HG22 ' A' ' 24' ' ' VAL . 25.5 m-80 -68.55 -46.71 68.75 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.124 0.57 . . . . 75.24 109.755 170.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -62.92 -43.57 98.42 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 123.589 0.756 . . . . 74.5 111.24 176.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.634 ' HB3' HD22 ' A' ' 60' ' ' LEU . 68.7 m-20 -56.51 -42.68 78.8 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.742 1.217 . . . . 64.22 111.768 175.69 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 32.5 ttm180 -61.37 -45.68 93.35 Favored 'General case' 0 N--CA 1.483 1.186 0 CA-C-N 115.48 -0.782 . . . . 73.45 110.917 175.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.446 HG22 ' O ' ' A' ' 20' ' ' ASN . 78.2 t -62.34 -41.69 92.6 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 C-N-CA 123.988 0.915 . . . . 72.43 112.207 -177.835 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 88.6 mt -61.2 -52.86 56.5 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 C-N-CA 122.327 0.251 . . . . 72.42 110.803 177.429 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.486 ' HG ' HD12 ' A' ' 60' ' ' LEU . 94.1 mt -58.65 -37.08 75.19 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.489 0.716 . . . . 75.43 112.18 176.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 28.3 tp -74.82 -50.55 16.78 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.61 0.764 . . . . 63.31 111.706 -174.351 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -74.64 -18.74 60.5 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 123.171 0.588 . . . . 65.13 112.162 -177.519 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 87.2 m -66.17 -30.14 70.56 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 122.628 0.371 . . . . 52.55 111.092 166.366 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -81.91 -24.49 35.64 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.995 0.518 . . . . 72.42 111.868 174.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.1 mptm? -71.83 -73.23 0.19 Allowed 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 121.27 0.557 . . . . 73.43 110.739 169.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.55 HH21 ' HG2' ' A' ' 37' ' ' LYS . 18.2 mtp180 -84.41 -53.99 5.07 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 123.941 0.896 . . . . 74.35 112.032 -171.238 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 131.25 163.35 10.87 Favored Glycine 0 N--CA 1.482 1.763 0 CA-C-O 119.525 -0.597 . . . . 73.04 113.076 -179.476 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -67.52 85.7 0.36 Allowed 'Trans proline' 0 C--N 1.379 2.142 0 C-N-CA 122.888 2.392 . . . . 75.05 111.905 173.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.2 m -141.72 148.55 39.21 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 124.108 0.963 . . . . 54.13 110.051 -176.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 89.9 p -61.76 -31.97 72.2 Favored 'General case' 0 N--CA 1.498 1.945 0 C-N-CA 123.281 0.632 . . . . 64.1 111.478 176.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.55 ' HG2' HH21 ' A' ' 32' ' ' ARG . 88.3 tttt -59.17 -34.45 72.13 Favored 'General case' 0 CA--C 1.561 1.397 0 C-N-CA 125.074 1.349 . . . . 75.33 111.751 173.229 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 87.5 m -79.11 -39.33 33.96 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 124.094 0.958 . . . . 72.33 110.18 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 26.7 m-85 -65.86 -26.89 67.85 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 115.179 -0.919 . . . . 75.23 111.95 175.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.31 -36.88 84.07 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.338 0.655 . . . . 71.42 111.668 173.206 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -66.44 -54.51 23.31 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 123.116 0.566 . . . . 74.01 110.642 172.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 96.1 mt -60.7 -23.06 64.58 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.459 1.104 . . . . 75.42 112.41 178.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.65 -57.5 9.86 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.231 0.612 . . . . 72.5 111.467 174.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -68.52 -27.58 66.24 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-N 115.544 -0.753 . . . . 75.23 112.161 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.443 ' HD3' HD21 ' A' ' 46' ' ' LEU . 0.6 OUTLIER -70.64 -58.18 3.94 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.731 0.813 . . . . 74.35 109.711 179.608 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.548 HD12 ' HZ3' ' A' ' 17' ' ' TRP . 41.4 mt -83.23 -5.35 59.1 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.475 0.71 . . . . 75.42 112.614 -173.402 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.1 t70 72.73 -2.71 2.58 Favored 'General case' 0 N--CA 1.498 1.935 0 C-N-CA 125.006 1.322 . . . . 64.14 112.146 -177.129 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.454 ' HA ' ' HE2' ' A' ' 48' ' ' LYS . 11.5 mmpt? -97.55 137.58 36.27 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.772 0.829 . . . . 73.4 110.058 -177.142 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 36.0 m-80 -52.19 149.44 9.77 Favored Pre-proline 0 N--CA 1.494 1.767 0 C-N-CA 123.49 0.716 . . . . 72.3 112.645 178.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -59.32 -22.12 63.87 Favored 'Trans proline' 0 C--N 1.387 2.601 0 C-N-CA 122.828 2.352 . . . . 73.5 113.082 -176.06 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -68.22 -43.76 77.28 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 124.022 0.929 . . . . 75.34 110.896 172.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 11.4 mm-40 -65.73 -41.88 91.7 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.393 0.677 . . . . 73.44 111.076 178.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 99.2 t -69.36 -43.83 80.73 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 C-N-CA 123.573 0.749 . . . . 64.24 111.807 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 93.5 p -62.67 -39.48 94.06 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.097 0.559 . . . . 74.4 111.029 179.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -72.5 -36.69 68.46 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 115.824 -0.625 . . . . 71.3 112.01 175.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -67.63 -34.97 78.05 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 122.775 0.43 . . . . 74.53 111.398 -179.195 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -53.63 -45.49 70.17 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.808 0.843 . . . . 75.21 110.242 169.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.519 ' O ' ' HG3' ' A' ' 62' ' ' LYS . 40.4 mt-30 -74.48 -30.33 61.8 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 114.984 -1.007 . . . . 74.23 112.052 178.462 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -68.46 -38.62 81.25 Favored 'General case' 0 N--CA 1.497 1.885 0 C-N-CA 123.908 0.883 . . . . 72.1 110.788 178.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.634 HD22 ' HB3' ' A' ' 22' ' ' ASP . 32.7 mt -53.62 -51.77 62.0 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.281 1.032 . . . . 74.51 110.245 168.44 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 45.5 mtt -68.88 -25.35 64.57 Favored 'General case' 0 CA--C 1.552 1.041 0 N-CA-C 113.335 0.865 . . . . 72.12 113.335 178.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.519 ' HG3' ' O ' ' A' ' 58' ' ' GLN . 60.8 mttp -63.7 -40.8 97.67 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-N 118.368 0.531 . . . . 70.32 110.048 173.356 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 75.2 mt -75.59 -41.6 54.13 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.52 0.728 . . . . 73.32 111.574 177.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 22.8 m-30 -65.2 -28.5 69.43 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.074 0.55 . . . . 75.34 111.598 177.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -71.61 -64.07 1.0 Allowed 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 108.698 -0.852 . . . . 73.44 108.698 172.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.442 ' HD3' ' HA ' ' A' ' 66' ' ' LYS . 44.7 mmtt -164.03 -72.54 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 125.612 1.565 . . . . 75.44 109.217 174.667 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 45.8 t -176.93 139.15 0.27 Allowed 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 124.454 1.102 . . . . 64.41 109.746 178.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.5 116.54 2.95 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.338 0.655 . . . . 74.53 110.286 177.062 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 60.9 m -79.83 -13.79 59.15 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.339 0.656 . . . . 55.41 112.658 -178.416 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.7 tmt_? . . . . . 0 CA--C 1.57 1.718 0 C-N-CA 125.311 1.444 . . . . 65.42 110.503 -179.639 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 80.9 p . . . . . 0 N--CA 1.494 1.77 0 CA-C-O 120.355 0.122 . . . . 73.22 110.888 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 77.5 m80 -138.21 120.31 15.63 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 124.014 0.925 . . . . 74.23 109.818 178.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 53.9 ttm -70.5 101.1 1.92 Allowed 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 123.586 0.754 . . . . 70.25 111.092 -178.722 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -115.59 -60.77 1.83 Allowed 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.52 0.728 . . . . 74.42 110.804 -179.595 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -75.43 81.2 2.48 Favored 'General case' 0 N--CA 1.481 1.114 0 CA-C-O 121.388 0.613 . . . . 71.33 109.846 177.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.5 p -135.34 137.67 49.63 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 C-N-CA 124.136 0.975 . . . . 73.02 110.275 -178.214 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.1 mp -88.39 107.59 17.79 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.917 0 N-CA-C 109.257 -0.645 . . . . 75.13 109.257 178.29 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.4 mtpp -69.46 83.34 0.4 Allowed 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 108.856 -0.794 . . . . 73.31 108.856 166.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.6 tmtt? -69.71 -57.03 5.63 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 115.642 -0.708 . . . . 73.44 109.267 -175.564 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 47.8 mtpt -138.89 175.94 9.12 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-O 121.68 0.753 . . . . 75.33 111.858 177.343 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 175.63 142.62 4.25 Favored Glycine 0 C--N 1.343 0.924 0 CA-C-N 114.514 -1.221 . . . . 63.34 110.66 174.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -79.86 84.67 5.6 Favored 'General case' 0 CA--C 1.556 1.194 0 CA-C-N 117.597 0.699 . . . . 72.43 109.707 -179.337 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.505 HG23 ' HB2' ' A' ' 17' ' ' TRP . 4.6 mp -135.42 131.67 51.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 C-N-CA 123.858 0.863 . . . . 74.21 110.001 174.012 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 14.3 tt -99.26 -28.08 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 C-N-CA 123.756 0.822 . . . . 74.22 111.148 174.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 70.1 mt -83.17 159.1 3.72 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.564 0 C-N-CA 124.689 1.196 . . . . 73.52 111.008 -177.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 60.2 tp -67.01 89.14 0.16 Allowed 'General case' 0 CA--C 1.559 1.313 0 CA-C-O 121.364 0.602 . . . . 71.1 112.041 178.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . 0.505 ' HB2' HG23 ' A' ' 13' ' ' ILE . 95.9 m95 -128.98 124.92 36.28 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.847 0.859 . . . . 74.34 110.212 176.187 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 72.2 p -131.68 168.1 18.32 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.43 1.092 . . . . 72.11 110.521 -172.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -56.59 -22.9 36.97 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 123.68 0.792 . . . . 73.11 113.113 -178.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.425 ' O ' HG21 ' A' ' 24' ' ' VAL . 10.9 m-80 -71.36 -49.79 38.77 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.54 0.736 . . . . 71.0 110.268 179.615 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -72.45 -41.76 65.74 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-N 115.675 -0.693 . . . . 74.02 110.101 -176.524 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.464 ' HB3' HD22 ' A' ' 60' ' ' LEU . 2.1 m-20 -51.31 -44.71 62.0 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 124.735 1.214 . . . . 74.54 111.805 172.253 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 60.6 ttp180 -60.61 -45.88 92.37 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.51 0.724 . . . . 74.24 111.554 175.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.425 HG21 ' O ' ' A' ' 20' ' ' ASN . 58.3 t -63.07 -37.0 78.21 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.353 0 C-N-CA 123.567 0.747 . . . . 75.12 111.378 -179.501 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 86.8 mt -64.13 -50.03 78.75 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 C-N-CA 122.813 0.445 . . . . 73.13 110.875 175.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 95.3 mt -59.36 -33.08 70.73 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 123.358 0.663 . . . . 63.34 111.946 176.519 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 45.8 tp -69.35 -58.13 4.4 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.41 0.684 . . . . 74.34 110.883 179.368 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.573 ' HA ' ' HB3' ' A' ' 31' ' ' LYS . 75.2 mm-40 -68.26 -23.19 64.75 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.576 0.75 . . . . 71.34 112.614 -177.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 54.1 t -68.17 -29.05 67.83 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.208 0.603 . . . . 74.23 111.98 174.246 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -104.02 -15.07 15.7 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 123.2 0.6 . . . . 62.33 112.023 176.488 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.573 ' HB3' ' HA ' ' A' ' 28' ' ' GLU . 43.7 tttm -82.65 -49.52 9.72 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 124.154 0.982 . . . . 64.45 110.805 177.025 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 88.4 mtt180 -99.17 -64.11 1.07 Allowed 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.676 0.79 . . . . 74.11 110.303 171.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 152.39 173.94 22.44 Favored Glycine 0 CA--C 1.539 1.548 0 CA-C-N 115.266 -0.879 . . . . 74.33 111.912 -172.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -86.02 31.46 0.47 Allowed 'Trans proline' 0 CA--C 1.56 1.814 0 C-N-CA 123.002 2.468 . . . . 64.11 113.879 -179.471 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 43.2 t -80.09 161.03 25.56 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 123.358 0.663 . . . . 75.22 112.611 -177.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 78.3 p -65.49 -28.19 69.02 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 124.099 0.96 . . . . 74.41 111.93 176.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -76.65 -18.97 58.28 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.405 0.682 . . . . 75.23 111.743 176.581 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 56.7 m -82.37 -38.4 24.21 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 109.203 -0.665 . . . . 62.41 109.203 171.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -64.76 -29.26 70.23 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 115.658 -0.701 . . . . 73.34 110.977 173.058 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.43 ' HA ' ' HG3' ' A' ' 50' ' ' PRO . . . -70.97 -34.79 71.76 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.668 0.787 . . . . 72.1 111.548 173.708 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -63.5 -54.96 28.16 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 109.726 -0.472 . . . . 74.32 109.726 171.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.402 ' HA ' ' HB3' ' A' ' 45' ' ' LYS . 52.2 mt -59.78 -24.73 64.33 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 125.271 1.428 . . . . 70.3 112.972 179.074 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.37 -55.47 17.99 Favored 'General case' 0 CA--C 1.552 1.03 0 CA-C-O 121.045 0.45 . . . . 53.12 110.742 172.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.49 -28.43 67.84 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.537 0.735 . . . . 71.04 112.118 177.568 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.402 ' HB3' ' HA ' ' A' ' 42' ' ' LEU . 23.1 tptm -76.2 -38.43 56.53 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.569 1.148 . . . . 74.11 111.594 -176.09 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 62.6 mt -112.52 11.32 19.74 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.659 0.784 . . . . 74.44 112.443 -173.331 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 64.37 21.71 12.56 Favored 'General case' 0 N--CA 1.506 2.359 0 C-N-CA 124.762 1.225 . . . . 72.12 112.684 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -109.94 -163.2 0.84 Allowed 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.725 0.81 . . . . 73.53 111.796 -175.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.432 ' HB2' HE21 ' A' ' 52' ' ' GLN . 26.1 m-80 -124.87 147.1 55.39 Favored Pre-proline 0 N--CA 1.487 1.385 0 C-N-CA 123.919 0.888 . . . . 75.21 109.984 178.882 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.43 ' HG3' ' HA ' ' A' ' 40' ' ' ALA . 50.6 Cg_exo -55.25 -27.99 59.72 Favored 'Trans proline' 0 C--N 1.382 2.32 0 C-N-CA 123.547 2.831 . . . . 72.2 115.659 -172.14 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -72.13 -44.81 62.55 Favored 'General case' 0 N--CA 1.494 1.768 0 C-N-CA 123.253 0.621 . . . . 64.21 111.117 176.015 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.432 HE21 ' HB2' ' A' ' 49' ' ' ASN . 43.4 mt-30 -57.46 -41.35 80.39 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 123.887 0.875 . . . . 72.24 111.993 172.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 66.8 t -69.78 -43.07 80.18 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.032 0 CA-C-N 115.76 -0.655 . . . . 74.45 111.291 177.722 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 45.2 t -60.01 -34.84 73.89 Favored 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 123.721 0.808 . . . . 73.24 111.658 177.332 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.19 -51.37 54.37 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 114.906 -1.043 . . . . 74.32 110.145 177.774 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.502 HH21 HG21 ' A' ' 13' ' ' ILE . 29.0 mmt-85 -65.8 -30.3 70.91 Favored 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 113.039 0.755 . . . . 74.53 113.039 -179.097 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.403 ' O ' ' HG2' ' A' ' 61' ' ' MET . 19.9 t80 -56.3 -52.94 62.66 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 122.738 0.415 . . . . 75.31 110.502 171.605 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 67.8 mt-30 -73.42 -24.93 60.33 Favored 'General case' 0 CA--C 1.554 1.099 0 CA-C-N 115.574 -0.739 . . . . 72.51 112.074 -176.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.406 ' O ' ' HG ' ' A' ' 63' ' ' LEU . 21.2 mm-40 -71.27 -43.11 67.82 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.302 0.641 . . . . 72.53 110.166 172.823 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.464 HD22 ' HB3' ' A' ' 22' ' ' ASP . 25.3 mt -58.64 -45.69 88.74 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 124.31 1.044 . . . . 75.32 111.659 174.687 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.403 ' HG2' ' O ' ' A' ' 57' ' ' PHE . 35.5 mmt -58.07 -39.83 79.49 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.129 0.572 . . . . 72.01 111.167 175.722 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 20.0 tptt -71.63 -28.34 63.71 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 115.65 -0.704 . . . . 72.15 111.8 -178.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 59' ' ' GLN . 96.4 mt -66.23 -31.67 72.62 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.288 0.635 . . . . 73.51 111.374 174.562 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -76.31 -43.38 41.57 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 122.962 0.505 . . . . 73.42 111.16 173.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -62.15 -45.18 94.56 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.858 0.863 . . . . 72.11 112.509 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -120.13 179.72 4.19 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.687 0.795 . . . . 75.12 112.009 -174.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 70.4 m -143.59 103.1 4.04 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.101 0.96 . . . . 65.12 109.533 176.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 95.0 mttt 68.73 118.26 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.131 0 C-N-CA 125.163 1.385 . . . . 75.53 112.288 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 83.0 m -72.05 -19.21 61.87 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 124.118 0.967 . . . . 73.34 113.404 -172.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 80.9 mtm180 . . . . . 0 CA--C 1.571 1.774 0 C-N-CA 124.554 1.142 . . . . 73.34 113.135 177.945 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 56.3 m . . . . . 0 N--CA 1.483 1.221 0 CA-C-O 121.208 0.528 . . . . 74.23 110.761 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 39.4 m80 -131.41 106.99 8.61 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 124.428 1.091 . . . . 74.54 109.287 178.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 62.2 mtt -109.29 151.18 26.91 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.582 0.753 . . . . 74.51 111.294 -177.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm -69.57 90.43 0.56 Allowed 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 123.071 0.548 . . . . 74.25 111.249 178.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -116.43 111.91 20.7 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.992 0.917 . . . . 73.4 108.904 177.475 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 12.5 m -57.06 114.17 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 C-N-CA 123.362 0.665 . . . . 71.2 112.234 -177.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 8.5 tt -71.0 95.29 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.56 1.358 0 CA-C-O 122.31 1.052 . . . . 74.14 111.889 -177.566 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -86.5 85.83 7.32 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 115.3 -0.864 . . . . 75.54 109.16 171.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.42 52.15 2.28 Favored 'General case' 0 N--CA 1.489 1.488 0 CA-C-N 115.16 -0.927 . . . . 74.3 112.494 -173.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -70.83 113.89 8.35 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.853 0.861 . . . . 74.15 110.117 172.291 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 171.0 -145.72 9.13 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 121.757 -0.258 . . . . 65.31 113.298 -178.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -103.55 10.09 37.2 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 123.503 0.721 . . . . 73.22 112.755 -174.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 26.5 mm -71.09 110.31 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 N-CA-C 109.592 -0.522 . . . . 74.33 109.592 175.057 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 46.0 pt -95.93 0.13 10.5 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 C-N-CA 123.804 0.842 . . . . 70.32 112.126 -177.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 3.8 mp -96.38 128.64 47.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 123.566 0.746 . . . . 74.41 109.444 -177.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 47.1 tp -71.58 101.36 2.48 Favored 'General case' 0 CA--C 1.556 1.185 0 CA-C-O 121.227 0.537 . . . . 64.54 110.902 179.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . 0.487 ' HZ2' ' HB3' ' A' ' 52' ' ' GLN . 93.2 m95 -112.13 167.6 10.27 Favored 'General case' 0 CA--C 1.56 1.347 0 C-N-CA 124.926 1.291 . . . . 74.32 110.512 176.919 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 80.6 p -119.54 -174.97 2.85 Favored 'General case' 0 N--CA 1.503 2.191 0 C-N-CA 123.746 0.818 . . . . 72.32 111.848 176.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 11.9 ptm180 -77.45 -18.59 57.05 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.243 0.617 . . . . 75.43 112.167 170.242 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -67.27 -36.08 80.84 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 123.499 0.719 . . . . 74.15 112.05 -176.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.38 -39.86 95.66 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 123.08 0.552 . . . . 74.2 111.035 -177.886 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.603 ' HA ' HD11 ' A' ' 60' ' ' LEU . 27.8 m-20 -49.93 -52.0 36.69 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.695 0.798 . . . . 73.34 111.313 175.487 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 42.0 ttt85 -58.77 -48.67 80.42 Favored 'General case' 0 CA--C 1.559 1.306 0 CA-C-N 114.834 -1.075 . . . . 75.01 112.707 176.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 89.0 t -65.52 -44.65 94.0 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 C-N-CA 123.896 0.878 . . . . 75.43 112.314 -175.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 97.3 mt -69.03 -50.24 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.122 0 C-N-CA 123.711 0.804 . . . . 74.21 111.164 -178.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.488 HD12 HD21 ' A' ' 60' ' ' LEU . 95.3 mt -57.79 -27.87 63.5 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 112.421 0.526 . . . . 74.03 112.421 175.616 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.3 tp -74.49 -60.81 2.11 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 122.954 0.502 . . . . 73.42 111.814 177.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.418 ' HB2' HD21 ' A' ' 42' ' ' LEU . 71.2 mm-40 -72.4 -26.35 61.84 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 113.335 0.865 . . . . 74.14 113.335 -172.705 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 71.7 m -67.16 -44.38 79.89 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-O 120.948 0.404 . . . . 74.42 111.7 -178.567 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.6 pt20 -79.25 -32.41 43.77 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 122.618 0.367 . . . . 74.45 111.86 177.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 28.8 ttpp -80.27 -33.38 37.83 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.322 0.649 . . . . 75.34 112.279 -173.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 48.0 mtt180 -102.19 -59.93 1.62 Allowed 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.166 0.586 . . . . 73.53 111.77 179.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 164.15 173.34 32.7 Favored Glycine 0 CA--C 1.536 1.37 0 N-CA-C 114.66 0.624 . . . . 71.45 114.66 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -87.65 3.15 6.41 Favored 'Trans proline' 0 CA--C 1.557 1.65 0 C-N-CA 123.47 2.78 . . . . 64.43 114.147 -177.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 32.3 t -65.07 151.11 46.86 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 123.782 0.833 . . . . 63.25 112.16 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 89.9 p -65.48 -18.38 65.27 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.314 0.646 . . . . 71.22 111.812 176.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.415 ' N ' ' HD2' ' A' ' 37' ' ' LYS . 0.2 OUTLIER -77.83 -15.01 59.38 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.745 0.818 . . . . 71.03 111.936 175.859 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 90.0 m -77.63 -39.55 44.88 Favored 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 108.845 -0.798 . . . . 74.3 108.845 169.817 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -65.38 -30.25 71.05 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.045 0.938 . . . . 75.13 111.313 172.095 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.72 -35.84 65.15 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.454 0.702 . . . . 71.13 111.584 175.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 56.1 t80 -65.19 -42.39 93.65 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-O 121.47 0.653 . . . . 65.04 110.602 170.839 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.465 HD22 ' HD3' ' A' ' 45' ' ' LYS . 50.4 mt -64.94 -32.92 74.87 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.842 0.857 . . . . 70.51 111.543 175.638 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.7 -35.56 81.1 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.285 0.634 . . . . 75.25 111.535 174.083 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.71 -45.82 81.29 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.177 0.591 . . . . 75.32 112.07 177.368 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.465 ' HD3' HD22 ' A' ' 42' ' ' LEU . 18.0 ptmt -86.05 -22.99 26.93 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 112.938 0.718 . . . . 72.23 112.938 -174.282 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 92.3 mt -90.55 -10.66 42.67 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.217 0.607 . . . . 74.32 111.475 171.393 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.3 t70 64.7 36.62 8.09 Favored 'General case' 0 CA--C 1.567 1.608 0 C-N-CA 124.269 1.027 . . . . 74.3 111.525 176.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -133.23 -168.69 2.13 Favored 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 124.005 0.922 . . . . 72.53 111.996 -176.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -85.86 144.98 40.22 Favored Pre-proline 0 N--CA 1.492 1.642 0 C-N-CA 123.335 0.654 . . . . 72.43 111.334 175.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -61.33 -31.0 88.62 Favored 'Trans proline' 0 C--N 1.388 2.609 0 C-N-CA 122.911 2.407 . . . . 73.43 112.847 177.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -65.79 -37.13 85.47 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.062 0.945 . . . . 71.2 110.855 177.335 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.487 ' HB3' ' HZ2' ' A' ' 17' ' ' TRP . 75.2 mm-40 -75.5 -31.23 60.1 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.508 0.723 . . . . 72.22 112.187 179.193 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 94.8 t -63.32 -40.27 88.42 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 C-N-CA 122.827 0.451 . . . . 64.35 110.293 170.069 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 37.9 t -62.67 -39.46 94.01 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.387 0.675 . . . . 52.45 111.809 177.444 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -53.55 -53.75 47.15 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 121.315 0.579 . . . . 72.31 110.679 174.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 9.7 mmm180 -61.1 -41.69 97.14 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 114.634 -1.166 . . . . 72.5 112.919 -178.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 40.4 t80 -57.91 -51.12 70.94 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 124.029 0.932 . . . . 73.54 112.442 176.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 -74.64 -24.81 58.89 Favored 'General case' 0 CA--C 1.555 1.148 0 CA-C-N 115.775 -0.648 . . . . 74.12 111.744 -176.05 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.447 ' O ' ' HG ' ' A' ' 63' ' ' LEU . 16.0 mm100 -75.47 -29.29 59.57 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.09 0.556 . . . . 75.44 110.692 170.068 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.603 HD11 ' HA ' ' A' ' 22' ' ' ASP . 9.8 mt -66.04 -41.75 90.47 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.827 0.851 . . . . 72.14 111.9 175.693 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 25.3 mmt -69.07 -26.96 65.21 Favored 'General case' 0 N--CA 1.484 1.238 0 CA-C-O 121.198 0.523 . . . . 74.25 111.321 175.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.624 ' HZ2' ' HB2' ' A' ' 62' ' ' LYS . 4.9 ttmp? -72.14 -40.08 68.3 Favored 'General case' 0 CA--C 1.561 1.371 0 C-N-CA 124.111 0.964 . . . . 75.34 111.038 172.303 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' A' ' 59' ' ' GLN . 95.9 mt -70.55 -30.97 67.83 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 123.585 0.754 . . . . 74.14 111.494 175.272 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -67.2 -40.27 86.44 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.735 0.814 . . . . 75.34 110.319 178.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -65.34 -39.01 91.86 Favored 'General case' 0 CA--C 1.555 1.157 0 C-N-CA 123.961 0.904 . . . . 74.22 111.232 172.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 45.8 mtpt 76.82 -29.36 0.17 Allowed 'General case' 0 N--CA 1.498 1.961 0 C-N-CA 126.129 1.772 . . . . 73.51 113.698 178.053 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 50.8 m -65.6 89.29 0.1 Allowed 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.665 0.786 . . . . 73.23 112.717 -173.127 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 10.4 tmtt? -74.77 83.23 2.13 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.93 0.892 . . . . 74.21 109.237 -179.356 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 39.0 t -105.01 -6.13 20.32 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.631 0.772 . . . . 71.13 111.764 -178.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 82.7 mtt180 . . . . . 0 C--O 1.254 1.317 0 C-N-CA 124.142 0.977 . . . . 74.53 110.634 176.982 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 41.9 t . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 120.272 0.082 . . . . 61.02 110.979 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 70.6 m80 -138.67 130.32 27.64 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 124.048 0.939 . . . . 45.4 110.007 178.881 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 52.3 ttm -159.38 93.85 1.14 Allowed 'General case' 0 N--CA 1.481 1.085 0 CA-C-O 121.156 0.503 . . . . 73.12 111.088 -179.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.6 mppt? -113.02 121.31 44.23 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 123.414 0.686 . . . . 73.52 109.34 172.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 24.8 p-10 -143.51 176.46 9.17 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.121 0.568 . . . . 74.31 112.139 -176.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 43.8 t 58.67 87.04 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.424 0 C-N-CA 125.074 1.35 . . . . 73.22 112.031 177.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 36.6 mm -93.08 -25.39 4.97 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.216 0 CA-C-N 115.41 -0.814 . . . . 74.42 110.721 -179.162 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 60.4 tttp -82.72 102.55 11.6 Favored 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 123.163 0.585 . . . . 75.42 110.207 174.66 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -99.05 143.36 29.41 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.838 0.855 . . . . 72.5 110.63 -178.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -90.63 46.8 1.36 Allowed 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 113.036 0.754 . . . . 74.2 113.036 -172.476 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 79.63 -8.68 47.4 Favored Glycine 0 CA--C 1.539 1.559 0 N-CA-C 115.62 1.008 . . . . 75.13 115.62 173.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -68.41 123.94 22.16 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-N 117.914 0.857 . . . . 74.23 109.416 177.329 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.515 HD13 HE21 ' A' ' 59' ' ' GLN . 28.7 mm 63.07 112.4 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.562 1.409 0 C-N-CA 125.226 1.41 . . . . 61.23 111.031 -166.815 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 2.4 mp -75.02 -29.71 22.46 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 C-N-CA 125.132 1.373 . . . . 72.11 111.054 -173.651 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 59.0 mt -66.21 137.92 23.98 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.272 0 C-N-CA 124.428 1.091 . . . . 74.04 111.87 -176.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 49.4 tp -73.47 85.92 1.53 Allowed 'General case' 0 CA--C 1.553 1.078 0 CA-C-O 121.44 0.638 . . . . 75.05 110.594 176.132 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -85.14 125.14 32.56 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 115.831 -0.622 . . . . 74.34 110.374 174.167 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' THR . . . . . 0.496 ' OG1' ' HB2' ' A' ' 21' ' ' ASP . 41.4 p -89.7 148.22 23.41 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 109.081 -0.711 . . . . 74.15 109.081 179.21 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -63.03 -20.09 64.99 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.28 0.632 . . . . 73.0 112.435 -172.44 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.435 ' O ' HG21 ' A' ' 24' ' ' VAL . 9.3 m120 -75.94 -47.09 26.55 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 123.507 0.723 . . . . 75.1 109.908 171.825 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.496 ' HB2' ' OG1' ' A' ' 18' ' ' THR . 0.4 OUTLIER -59.96 -55.79 29.76 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 125.208 1.403 . . . . 74.55 111.783 -173.563 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.534 ' HB2' HD22 ' A' ' 60' ' ' LEU . 1.6 p30 -64.49 -32.51 74.17 Favored 'General case' 0 CA--C 1.557 1.238 0 CA-C-N 115.735 -0.666 . . . . 73.43 112.573 179.786 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -64.58 -38.02 89.57 Favored 'General case' 0 CA--C 1.56 1.335 0 C-N-CA 123.011 0.524 . . . . 74.3 111.395 174.011 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.435 HG21 ' O ' ' A' ' 20' ' ' ASN . 99.1 t -67.69 -32.14 55.48 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 C-N-CA 123.182 0.593 . . . . 74.33 111.239 176.262 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 91.5 mt -56.6 -54.91 23.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 C-N-CA 122.238 0.215 . . . . 71.34 110.907 173.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.493 ' HG ' HD12 ' A' ' 60' ' ' LEU . 98.7 mt -57.8 -44.07 86.08 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 123.394 0.678 . . . . 72.25 111.757 176.184 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 39.5 tp -60.57 -49.46 77.46 Favored 'General case' 0 CA--C 1.561 1.397 0 C-N-CA 124.286 1.034 . . . . 64.41 112.452 -177.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -77.78 -20.35 53.47 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.575 0.75 . . . . 74.5 112.539 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 69.4 m -74.12 -29.27 61.75 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-O 120.846 0.355 . . . . 73.42 110.732 170.33 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 91.7 mt-30 -75.41 -19.58 59.43 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.215 0.606 . . . . 75.33 111.42 170.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 35.8 ttmt -82.88 -69.76 0.6 Allowed 'General case' 0 CA--C 1.559 1.302 0 C-N-CA 123.512 0.725 . . . . 75.23 111.407 173.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 51.6 mtp180 -81.07 -42.14 21.49 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.582 0.753 . . . . 74.43 112.699 -174.377 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 122.74 161.08 11.11 Favored Glycine 0 CA--C 1.54 1.609 0 CA-C-O 119.711 -0.494 . . . . 63.31 112.784 -175.335 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -69.27 92.66 0.47 Allowed 'Trans proline' 0 C--N 1.374 1.901 0 C-N-CA 122.608 2.206 . . . . 73.13 111.914 173.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 43.6 t -148.47 157.74 43.66 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 123.084 0.554 . . . . 73.02 112.287 -174.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 95.4 p -63.63 -29.54 70.77 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 123.569 0.747 . . . . 75.15 111.092 175.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -63.57 -34.88 78.78 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.772 0.829 . . . . 75.44 111.019 175.174 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 21.5 m -82.94 -33.32 26.78 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 115.249 -0.887 . . . . 72.04 110.054 -177.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -68.63 -38.17 80.29 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.372 0.669 . . . . 74.11 111.104 175.474 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . 0.416 ' HA ' ' HG3' ' A' ' 50' ' ' PRO . . . -69.35 -35.3 75.74 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.378 0.671 . . . . 72.24 111.275 174.252 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -66.43 -47.71 72.33 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 123.522 0.729 . . . . 73.52 111.435 177.08 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 25.9 mt -69.17 -24.22 64.03 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.49 1.116 . . . . 73.54 111.986 176.347 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.51 -47.34 82.11 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-O 121.091 0.472 . . . . 73.32 110.601 170.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -68.09 -39.69 82.81 Favored 'General case' 0 CA--C 1.557 1.213 0 C-N-CA 123.588 0.755 . . . . 71.54 112.058 177.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 32.3 ttmt -73.94 -36.51 64.66 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 124.094 0.958 . . . . 72.52 112.223 -176.568 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 82.6 mt -108.27 9.56 27.94 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 112.882 0.697 . . . . 74.43 112.882 -174.202 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 66.71 11.73 8.38 Favored 'General case' 0 N--CA 1.503 2.194 0 C-N-CA 124.73 1.212 . . . . 64.55 112.944 -179.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm -91.65 -163.99 1.12 Allowed 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 124.068 0.947 . . . . 75.31 112.049 -175.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -124.81 149.75 63.64 Favored Pre-proline 0 CA--C 1.567 1.63 0 C-N-CA 124.087 0.955 . . . . 74.21 109.212 174.464 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.416 ' HG3' ' HA ' ' A' ' 40' ' ' ALA . 84.5 Cg_exo -48.68 -44.22 31.68 Favored 'Trans proline' 0 C--N 1.391 2.769 0 C-N-CA 123.782 2.988 . . . . 74.43 115.755 -173.879 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -68.51 -35.22 77.18 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 122.51 0.324 . . . . 73.43 111.315 -179.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 -62.69 -45.97 90.34 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 123.345 0.658 . . . . 74.2 111.076 175.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 98.8 t -62.2 -40.7 88.6 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.04 0 CA-C-N 115.503 -0.771 . . . . 74.42 111.252 176.525 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.0 t -68.71 -45.13 72.38 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.902 0.881 . . . . 75.11 112.765 -175.711 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -64.88 -42.16 95.06 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 122.694 0.398 . . . . 74.31 110.878 178.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 22.3 tpt180 -66.39 -39.34 88.99 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 122.592 0.357 . . . . 74.34 110.785 177.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 34.4 t80 -51.24 -53.13 38.3 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 124.57 1.148 . . . . 73.22 112.371 178.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -73.66 -23.09 59.8 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 112.72 0.637 . . . . 74.34 112.72 -177.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.515 HE21 HD13 ' A' ' 13' ' ' ILE . 2.6 mp0 -75.88 -26.0 56.65 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 123.208 0.603 . . . . 74.15 110.783 172.233 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.534 HD22 ' HB2' ' A' ' 22' ' ' ASP . 42.1 mt -74.6 -40.72 61.41 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.818 0.847 . . . . 75.23 110.98 171.587 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.542 ' HA ' ' HD2' ' A' ' 64' ' ' PHE . 84.0 mtp -70.99 -27.32 63.62 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.436 0.694 . . . . 63.02 111.202 176.54 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -57.19 -38.41 73.61 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.029 0.931 . . . . 74.04 110.846 169.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 78.3 mt -65.74 -39.21 90.88 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.272 0.629 . . . . 74.33 111.496 176.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.542 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 52.3 m-85 -66.99 -30.17 70.21 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 122.803 0.441 . . . . 75.51 111.762 175.714 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -71.04 -48.18 54.32 Favored 'General case' 0 CA--C 1.554 1.107 0 CA-C-O 120.844 0.354 . . . . 54.34 110.532 173.051 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -168.86 125.41 0.96 Allowed 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.649 0.78 . . . . 75.43 111.276 -177.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 70.7 m -108.13 137.46 46.08 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 123.622 0.769 . . . . 75.22 110.627 175.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -116.9 -165.12 1.03 Allowed 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.59 0.756 . . . . 72.21 111.944 179.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 47.5 t 67.33 81.97 0.19 Allowed 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 125.117 1.367 . . . . 74.45 110.623 -173.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 5.3 ppt_? . . . . . 0 CA--C 1.569 1.684 0 C-N-CA 123.79 0.836 . . . . 74.4 112.545 -177.866 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 39.6 m . . . . . 0 N--CA 1.492 1.63 0 N-CA-C 110.532 -0.173 . . . . 74.21 110.532 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 40.7 t-80 -78.05 82.98 4.37 Favored 'General case' 0 N--CA 1.485 1.283 0 CA-C-O 121.236 0.541 . . . . 73.44 109.708 177.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 49.5 ttm -89.63 135.42 33.62 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.369 0.668 . . . . 74.24 111.002 -175.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -115.55 130.92 57.04 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.193 0.997 . . . . 71.32 109.279 173.482 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 34.4 t-20 -89.1 87.9 7.36 Favored 'General case' 0 CA--C 1.557 1.243 0 N-CA-C 109.39 -0.596 . . . . 63.32 109.39 177.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.1 p -67.97 -35.09 70.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 C-N-CA 123.285 0.634 . . . . 71.44 111.93 -177.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.451 HG13 ' H ' ' A' ' 9' ' ' LYS . 34.6 pt -77.32 -26.11 15.39 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.258 0 C-N-CA 123.425 0.69 . . . . 75.11 111.549 179.769 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt 60.51 32.46 20.48 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 124.906 1.282 . . . . 74.0 113.362 178.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.451 ' H ' HG13 ' A' ' 7' ' ' ILE . 1.2 mptm? -98.04 176.97 5.57 Favored 'General case' 0 CA--C 1.558 1.262 0 C-N-CA 123.864 0.866 . . . . 74.12 110.317 171.087 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 58.5 mttp 67.73 -72.18 0.1 Allowed 'General case' 0 N--CA 1.498 1.931 0 C-N-CA 125.175 1.39 . . . . 72.14 112.343 -178.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -69.66 87.66 0.28 Allowed Glycine 0 C--N 1.353 1.48 0 C-N-CA 122.976 0.322 . . . . 71.33 113.492 179.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -83.37 135.09 34.84 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.046 0.538 . . . . 73.2 111.044 -179.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 24.1 mm -79.21 -8.74 11.77 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.736 0 C-N-CA 124.03 0.932 . . . . 74.24 112.884 -168.444 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.569 HG21 HG12 ' A' ' 15' ' ' ILE . 11.2 tt -50.45 -34.45 11.81 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.162 0 CA-C-O 121.938 0.875 . . . . 74.4 112.053 176.425 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.569 HG12 HG21 ' A' ' 14' ' ' ILE . 4.6 pt -129.04 100.91 5.97 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 CA-C-N 114.654 -1.157 . . . . 73.43 109.759 178.188 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 41.8 tp -75.94 78.23 2.83 Favored 'General case' 0 CA--C 1.55 0.969 0 CA-C-O 121.709 0.766 . . . . 73.15 110.173 178.449 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . 0.442 ' CH2' ' HG3' ' A' ' 48' ' ' LYS . 99.0 m95 -80.67 123.63 28.33 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-N 114.926 -1.034 . . . . 73.24 110.04 169.866 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 21.7 p -111.72 164.28 13.21 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 108.551 -0.907 . . . . 70.01 108.551 174.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 27.3 ptt-85 -57.59 -19.84 28.49 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.305 0.642 . . . . 73.15 112.465 178.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.424 ' O ' HG21 ' A' ' 24' ' ' VAL . 28.0 m-80 -70.86 -49.31 47.44 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.45 0.7 . . . . 71.52 110.754 174.556 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -62.24 -57.05 12.86 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.676 0.79 . . . . 71.24 112.272 -176.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.415 ' HB2' HD13 ' A' ' 60' ' ' LEU . 2.2 p30 -64.68 -31.89 73.31 Favored 'General case' 0 CA--C 1.555 1.162 0 C-N-CA 123.335 0.654 . . . . 72.31 112.399 -176.285 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -62.75 -39.24 93.54 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.557 0.743 . . . . 74.4 111.821 174.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.424 HG21 ' O ' ' A' ' 20' ' ' ASN . 62.4 t -65.61 -38.45 82.37 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 C-N-CA 122.969 0.508 . . . . 72.34 110.577 174.437 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 70.5 mt -59.87 -47.16 92.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 CA-C-O 120.96 0.409 . . . . 74.32 110.951 174.641 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.453 HD12 HD21 ' A' ' 60' ' ' LEU . 88.9 mt -62.86 -36.81 84.5 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.201 1.0 . . . . 72.11 112.09 178.255 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 53.5 tp -67.71 -53.85 24.22 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.339 0.656 . . . . 73.14 111.289 178.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.488 ' HA ' ' HB3' ' A' ' 31' ' ' LYS . 8.2 mm-40 -71.12 -20.78 62.28 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.737 0.815 . . . . 75.11 112.426 -176.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 35.7 t -67.05 -30.97 71.18 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.091 0.557 . . . . 53.45 111.699 171.316 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 24.3 mm-40 -96.86 -23.69 16.24 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.0 0.52 . . . . 74.35 111.501 177.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.488 ' HB3' ' HA ' ' A' ' 28' ' ' GLU . 58.6 tptt -76.17 -58.01 3.53 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.896 0.879 . . . . 74.24 110.649 179.37 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -90.82 -60.27 1.96 Allowed 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.641 0.777 . . . . 74.24 109.818 176.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 148.15 178.94 23.72 Favored Glycine 0 CA--C 1.536 1.375 0 CA-C-N 115.11 -0.95 . . . . 75.21 112.285 -175.245 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -82.83 35.77 0.59 Allowed 'Trans proline' 0 CA--C 1.562 1.906 0 C-N-CA 123.21 2.606 . . . . 73.41 112.762 174.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 30.3 t -72.36 145.54 47.68 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.959 0.904 . . . . 62.31 111.455 -179.342 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 80.2 p -61.3 -31.93 71.77 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.317 0.647 . . . . 74.5 111.311 173.365 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.1 tmtm? -65.34 -33.68 76.55 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 124.406 1.082 . . . . 75.43 110.889 174.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 56.2 m -75.04 -38.99 61.27 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.344 0.658 . . . . 64.13 109.786 -179.116 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 28.1 m-85 -67.26 -32.48 73.53 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 123.527 0.731 . . . . 75.42 112.066 174.46 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.14 -34.68 66.23 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.598 0.759 . . . . 64.55 111.324 174.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -63.0 -48.81 77.22 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 123.587 0.755 . . . . 74.23 110.536 172.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.424 ' HB2' HG12 ' A' ' 53' ' ' VAL . 44.4 mt -64.94 -29.31 70.24 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 124.644 1.178 . . . . 75.03 112.226 177.415 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.76 -50.53 68.69 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.13 0.572 . . . . 55.52 110.993 171.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.1 -27.6 62.75 Favored 'General case' 0 CA--C 1.558 1.282 0 C-N-CA 123.16 0.584 . . . . 72.1 112.368 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.53 -51.76 11.08 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.809 0.844 . . . . 73.45 109.959 -178.593 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 63.5 mt -87.1 2.53 49.46 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.872 0.869 . . . . 64.43 111.897 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 62.29 24.02 14.26 Favored 'General case' 0 N--CA 1.497 1.913 0 C-N-CA 124.67 1.188 . . . . 71.31 113.035 178.546 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.442 ' HG3' ' CH2' ' A' ' 17' ' ' TRP . 72.2 mmtt -96.94 -167.62 1.58 Allowed 'General case' 0 CA--C 1.558 1.252 0 C-N-CA 124.948 1.299 . . . . 73.43 111.144 177.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 24.8 m-80 -105.81 144.55 29.12 Favored Pre-proline 0 N--CA 1.492 1.631 0 C-N-CA 123.683 0.793 . . . . 75.23 110.376 175.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -63.32 -29.8 72.9 Favored 'Trans proline' 0 C--N 1.384 2.417 0 C-N-CA 122.794 2.329 . . . . 73.45 113.037 -175.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -61.12 -49.69 76.23 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.014 0.926 . . . . 73.21 110.334 174.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.464 ' O ' ' HG2' ' A' ' 56' ' ' ARG . 76.3 mt-30 -55.4 -55.64 29.36 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 115.391 -0.822 . . . . 75.44 111.492 176.719 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.424 HG12 ' HB2' ' A' ' 42' ' ' LEU . 84.6 t -55.98 -45.79 80.3 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.305 0 C-N-CA 124.036 0.934 . . . . 73.34 112.468 -174.35 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 32.8 t -61.39 -43.84 98.18 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.377 0.671 . . . . 64.11 111.698 178.594 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -65.89 -44.93 83.8 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.352 0.661 . . . . 73.44 111.801 178.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.464 ' HG2' ' O ' ' A' ' 52' ' ' GLN . 2.4 mmp_? -65.71 -35.82 81.85 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 122.492 0.317 . . . . 75.11 111.094 -176.35 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.517 ' HA ' HD12 ' A' ' 60' ' ' LEU . 17.0 t80 -53.77 -49.86 67.3 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.959 0.904 . . . . 75.14 111.708 172.241 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -71.8 -25.0 61.82 Favored 'General case' 0 CA--C 1.552 1.034 0 CA-C-N 115.506 -0.77 . . . . 74.3 111.64 -176.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -76.29 -39.4 54.31 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.033 0.533 . . . . 71.14 110.527 173.017 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.517 HD12 ' HA ' ' A' ' 57' ' ' PHE . 16.3 mt -54.26 -46.34 72.61 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 124.712 1.205 . . . . 74.21 111.563 177.27 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 31.7 mmt -56.06 -44.65 79.08 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.77 0.828 . . . . 75.2 111.498 175.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -71.09 -29.36 65.19 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.641 0.776 . . . . 73.23 112.512 178.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 93.0 mt -70.13 -38.88 75.66 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.095 0.558 . . . . 74.42 111.319 177.19 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 30.3 m-85 -62.29 -24.67 67.43 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 122.639 0.376 . . . . 74.34 111.943 174.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -80.62 -59.91 2.51 Favored 'General case' 0 CA--C 1.556 1.179 0 C-N-CA 123.271 0.628 . . . . 74.34 110.693 174.235 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . 0.67 ' HZ2' ' HB2' ' A' ' 66' ' ' LYS . 8.5 mtmp? -158.79 -169.16 2.61 Favored 'General case' 0 N--CA 1.504 2.225 0 C-N-CA 125.142 1.377 . . . . 74.25 110.659 -173.456 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 23.0 t 67.53 16.4 9.92 Favored 'General case' 0 N--CA 1.502 2.15 0 N-CA-C 114.639 1.348 . . . . 75.45 114.639 164.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 35.1 mtmm -71.48 122.06 19.75 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 112.939 0.718 . . . . 73.41 112.939 179.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 84.6 m -135.56 120.65 18.82 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.433 1.093 . . . . 65.42 109.115 170.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.561 1.397 0 C-N-CA 123.645 0.778 . . . . 73.33 109.255 -178.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 78.8 p . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 120.821 0.343 . . . . 61.3 111.476 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 69.8 t60 -154.69 152.34 29.81 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.773 0.829 . . . . 73.15 110.504 177.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 24.5 mmt -74.09 156.97 36.87 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-O 121.362 0.601 . . . . 74.24 112.058 178.38 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.692 ' HZ2' ' HB2' ' A' ' 4' ' ' LYS . 4.7 ttmp? -85.21 149.2 25.67 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 124.122 0.969 . . . . 73.35 113.069 -169.242 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 24.2 p-10 -79.68 143.28 34.75 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.323 0.649 . . . . 73.52 111.027 174.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 68.9 t -96.68 126.61 49.34 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 C-N-CA 123.177 0.591 . . . . 74.41 110.57 176.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.7 mp -72.06 106.96 2.68 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.087 0 N-CA-C 108.858 -0.793 . . . . 75.22 108.858 175.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -68.25 -45.15 73.99 Favored 'General case' 0 CA--C 1.558 1.287 0 C-N-CA 123.687 0.795 . . . . 74.24 110.893 -176.263 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.4 ' HG2' ' N ' ' A' ' 10' ' ' LYS . 38.5 ttmt 63.69 167.84 0.15 Allowed 'General case' 0 N--CA 1.502 2.165 0 C-N-CA 124.725 1.21 . . . . 71.54 111.82 -178.6 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.4 ' N ' ' HG2' ' A' ' 9' ' ' LYS . 34.8 mtmt 68.25 108.8 0.05 OUTLIER 'General case' 0 N--CA 1.495 1.782 0 C-N-CA 124.15 0.98 . . . . 72.4 111.738 174.194 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -62.53 102.39 0.49 Allowed Glycine 0 CA--C 1.536 1.356 0 N-CA-C 114.96 0.744 . . . . 53.13 114.96 -172.245 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -101.63 158.82 15.82 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.734 0.813 . . . . 75.34 110.496 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.461 ' H ' HD13 ' A' ' 13' ' ' ILE . 2.6 mp -85.67 59.14 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 CA-C-O 122.736 1.255 . . . . 74.31 110.068 -174.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 45.8 pt -122.14 6.22 5.75 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 C-N-CA 125.435 1.494 . . . . 74.11 111.019 178.251 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 17.3 mm 69.33 111.42 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 C-N-CA 125.674 1.59 . . . . 73.31 110.508 -170.032 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.0 mp -78.84 70.67 5.22 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.959 0.904 . . . . 74.02 111.61 -173.58 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . 0.462 ' HZ2' ' HB3' ' A' ' 52' ' ' GLN . 96.7 m95 -68.42 126.91 31.09 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.531 0.732 . . . . 75.45 111.407 177.681 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 25.9 p -103.17 164.6 11.52 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 120.979 0.419 . . . . 75.5 111.111 177.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.43 ' HA ' ' HE ' ' A' ' 19' ' ' ARG . 0.4 OUTLIER -60.34 -21.89 62.6 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.965 0.906 . . . . 75.2 112.377 -177.715 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -74.97 -49.51 19.76 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 123.739 0.816 . . . . 74.24 110.902 176.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 59.9 m-20 -59.82 -53.32 59.32 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 123.471 0.708 . . . . 71.22 112.092 -175.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.573 ' HB2' HD22 ' A' ' 60' ' ' LEU . 2.9 p30 -62.66 -32.42 73.47 Favored 'General case' 0 CA--C 1.561 1.372 0 CA-C-N 115.371 -0.832 . . . . 62.42 112.216 -177.579 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 35.7 ttm180 -70.54 -40.39 73.44 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.764 0.825 . . . . 73.04 111.57 176.758 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 45.8 t -61.81 -39.6 84.01 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.344 0 C-N-CA 123.665 0.786 . . . . 74.41 111.22 175.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 90.8 mt -56.24 -53.96 33.41 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 C-N-CA 123.206 0.602 . . . . 72.31 111.219 174.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 96.5 mt -62.49 -46.85 86.57 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.267 0.627 . . . . 75.15 112.18 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 49.1 tp -61.89 -50.3 72.75 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.973 0.909 . . . . 73.43 112.145 -174.644 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.509 ' HB2' HD22 ' A' ' 42' ' ' LEU . 31.1 mt-10 -76.85 -18.27 58.47 Favored 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 112.757 0.651 . . . . 75.32 112.757 -179.01 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 61.9 m -70.02 -29.43 66.48 Favored 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 122.508 0.323 . . . . 74.13 111.108 165.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 -83.7 -20.58 33.25 Favored 'General case' 0 N--CA 1.492 1.626 0 C-N-CA 122.901 0.481 . . . . 74.45 111.984 174.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -74.05 -44.72 53.28 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 122.996 0.519 . . . . 73.21 110.422 171.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 73.9 mtp180 -108.83 -70.98 0.78 Allowed 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.641 0.776 . . . . 75.3 111.954 -173.202 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 155.62 147.57 4.76 Favored Glycine 0 CA--C 1.54 1.617 0 CA-C-O 119.059 -0.856 . . . . 71.24 112.197 -175.292 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -65.67 86.2 0.22 Allowed 'Trans proline' 0 C--N 1.378 2.116 0 C-N-CA 123.234 2.623 . . . . 71.25 112.622 175.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 29.3 t -130.26 155.36 46.42 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 124.023 0.929 . . . . 64.41 110.818 -177.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 81.9 p -66.89 -29.41 69.3 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.259 0.623 . . . . 65.5 111.671 176.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -68.26 -32.06 71.97 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.148 0.579 . . . . 72.54 110.849 172.258 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 66.8 m -79.79 -33.51 40.47 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.218 0.607 . . . . 71.22 109.604 -179.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -69.43 -32.77 71.94 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.396 0.678 . . . . 73.51 111.048 173.195 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.8 -35.2 72.43 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.533 0.733 . . . . 75.12 111.287 173.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -62.93 -50.57 70.3 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.478 0.711 . . . . 73.11 111.121 172.075 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.509 HD22 ' HB2' ' A' ' 28' ' ' GLU . 54.8 mt -66.44 -23.38 66.28 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 124.411 1.085 . . . . 72.23 111.894 178.697 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.12 -45.99 82.83 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.15 0.58 . . . . 72.15 111.166 169.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.1 -32.56 65.05 Favored 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 123.347 0.659 . . . . 75.54 111.953 176.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.432 ' HB3' ' HA ' ' A' ' 42' ' ' LEU . 23.8 tptp -76.92 -34.24 57.69 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.906 1.282 . . . . 73.34 111.677 -173.917 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 92.2 mt -102.82 -5.24 23.84 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 123.73 0.812 . . . . 75.3 112.14 175.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.3 t70 65.2 31.53 10.72 Favored 'General case' 0 CA--C 1.574 1.883 0 C-N-CA 124.583 1.153 . . . . 70.4 111.215 -178.162 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -110.03 -177.2 3.19 Favored 'General case' 0 N--CA 1.495 1.812 0 C-N-CA 124.53 1.132 . . . . 75.32 111.984 -178.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -85.98 140.98 35.13 Favored Pre-proline 0 N--CA 1.489 1.489 0 C-N-CA 123.293 0.637 . . . . 72.41 110.853 173.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -66.63 -24.68 47.84 Favored 'Trans proline' 0 C--N 1.38 2.222 0 C-N-CA 122.4 2.067 . . . . 72.11 113.039 -177.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -67.34 -47.05 71.64 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.522 0.729 . . . . 64.03 110.186 173.293 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.462 ' HB3' ' HZ2' ' A' ' 17' ' ' TRP . 84.2 mm-40 -60.62 -32.5 71.64 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.695 0.798 . . . . 64.5 112.081 177.112 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.461 HG11 ' HB2' ' A' ' 42' ' ' LEU . 88.8 t -74.95 -45.12 43.9 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.224 0 C-N-CA 123.859 0.864 . . . . 75.0 111.681 177.979 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 87.4 p -63.91 -42.51 97.38 Favored 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 123.1 0.56 . . . . 74.23 111.318 -179.639 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -60.61 -41.29 94.47 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.714 0.805 . . . . 73.5 111.432 172.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 1.2 tpp180 -64.16 -42.86 96.56 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 122.985 0.514 . . . . 74.33 111.736 -174.023 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -51.38 -48.65 62.48 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 124.002 0.921 . . . . 73.44 111.626 173.271 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -73.27 -32.52 64.71 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-N 115.551 -0.75 . . . . 75.24 112.301 -174.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 17.6 mm-40 -70.94 -41.76 70.71 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.296 0.638 . . . . 74.21 110.479 175.24 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.573 HD22 ' HB2' ' A' ' 22' ' ' ASP . 7.5 mt -53.11 -44.11 67.38 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 124.908 1.283 . . . . 74.14 112.787 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 31.6 mmt -55.28 -43.47 74.78 Favored 'General case' 0 CA--C 1.558 1.288 0 O-C-N 123.962 0.789 . . . . 74.53 111.11 177.075 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -75.91 -29.8 58.54 Favored 'General case' 0 CA--C 1.558 1.279 0 C-N-CA 124.336 1.054 . . . . 72.34 112.623 178.113 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 93.7 mt -71.06 -30.6 66.8 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 123.7 0.8 . . . . 73.35 112.281 -178.176 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 44.0 m-85 -57.09 -53.62 56.02 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 122.795 0.438 . . . . 64.31 110.934 174.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -73.77 -28.12 61.51 Favored 'General case' 0 CA--C 1.556 1.208 0 C-N-CA 123.134 0.574 . . . . 73.22 111.559 178.442 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 65.6 tttp 61.1 79.1 0.26 Allowed 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 124.84 1.256 . . . . 63.21 110.957 179.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 31.4 t -131.38 22.39 4.77 Favored 'General case' 0 N--CA 1.491 1.598 0 CA-C-N 115.393 -0.821 . . . . 74.45 111.453 -175.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -126.42 94.66 4.13 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.449 0.699 . . . . 72.14 111.467 -178.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 87.4 m -91.61 89.49 7.18 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.245 0.618 . . . . 64.33 109.672 170.66 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 26.1 tpt180 . . . . . 0 CA--C 1.564 1.513 0 CA-C-O 118.641 -0.695 . . . . 73.33 110.648 -179.402 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 41.1 t . . . . . 0 N--CA 1.486 1.356 0 N-CA-C 111.689 0.255 . . . . 71.11 111.689 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 30.1 m-70 63.0 12.98 6.31 Favored 'General case' 0 N--CA 1.498 1.973 0 C-N-CA 124.469 1.108 . . . . 75.31 113.034 -172.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 25.6 mmt -79.98 133.11 36.15 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 108.14 -1.059 . . . . 61.44 108.14 167.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -56.48 151.22 13.73 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.154 0.582 . . . . 70.11 112.245 -179.014 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -60.14 132.68 54.67 Favored 'General case' 0 N--CA 1.479 0.992 0 N-CA-C 108.873 -0.788 . . . . 72.5 108.873 170.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 64.7 t -53.46 102.41 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.831 0 C-N-CA 123.16 0.584 . . . . 73.42 112.151 -170.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 54.5 mt -83.09 121.7 36.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 C-N-CA 123.799 0.839 . . . . 72.45 110.086 -177.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.457 ' HZ3' ' HA ' ' A' ' 19' ' ' ARG . 49.5 tptt -94.15 -57.11 2.61 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 122.941 0.496 . . . . 74.15 111.533 -176.939 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.2 tppt? 61.87 97.91 0.03 OUTLIER 'General case' 0 CA--C 1.561 1.39 0 C-N-CA 124.819 1.248 . . . . 64.42 112.027 -172.003 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -140.52 62.03 1.5 Allowed 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 124.601 1.16 . . . . 75.3 108.634 178.739 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -73.08 -64.72 2.46 Favored Glycine 0 C--N 1.35 1.347 0 CA-C-N 115.337 -0.847 . . . . 73.0 113.358 -175.517 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -96.37 169.53 9.86 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.243 0.617 . . . . 74.22 110.553 175.18 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.2 mp -93.02 130.88 41.45 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 C-N-CA 123.013 0.525 . . . . 74.34 110.375 -175.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 10.4 tt -147.02 76.76 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 C-N-CA 124.53 1.132 . . . . 74.31 108.51 173.173 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 27.1 mt 67.14 140.11 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 C-N-CA 124.93 1.292 . . . . 74.33 111.488 -176.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.9 mp -76.33 83.82 3.1 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-O 121.995 0.903 . . . . 74.24 111.289 -179.292 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 85.1 m95 -97.97 134.56 40.9 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.175 1.39 . . . . 74.12 109.869 174.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 24.8 p -98.47 156.61 16.69 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 109.293 -0.632 . . . . 74.34 109.293 176.06 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.457 ' HA ' ' HZ3' ' A' ' 8' ' ' LYS . 6.3 ptm180 -58.47 -21.16 50.6 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 113.869 1.062 . . . . 74.33 113.869 -173.77 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.421 ' O ' HG21 ' A' ' 24' ' ' VAL . 3.6 t-20 -74.32 -49.16 24.1 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 122.784 0.433 . . . . 73.13 110.403 176.582 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.6 -58.09 9.57 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.24 1.016 . . . . 74.23 113.287 -177.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.544 ' HB2' HD12 ' A' ' 60' ' ' LEU . 3.0 p30 -63.36 -31.73 72.97 Favored 'General case' 0 CA--C 1.56 1.342 0 C-N-CA 122.748 0.419 . . . . 63.23 111.914 -177.752 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 42.7 ttt-85 -64.97 -35.48 81.32 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 123.261 0.624 . . . . 74.53 111.541 174.862 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.421 HG21 ' O ' ' A' ' 20' ' ' ASN . 90.2 t -70.77 -33.77 53.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 C-N-CA 123.276 0.631 . . . . 61.45 111.017 174.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 95.0 mt -57.93 -46.99 87.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 CA-C-O 120.707 0.289 . . . . 71.5 110.419 172.503 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.622 HD22 ' HB3' ' A' ' 60' ' ' LEU . 96.1 mt -60.77 -38.5 85.48 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.845 0.858 . . . . 74.12 112.313 176.392 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 40.4 tp -68.9 -47.44 65.8 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.462 0.705 . . . . 74.22 111.733 -179.434 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -75.69 -23.59 56.19 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.301 0.64 . . . . 74.24 111.913 -179.19 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . 0.456 ' SG ' ' HE1' ' A' ' 57' ' ' PHE . 34.7 t -64.76 -31.03 72.07 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.417 0.687 . . . . 74.24 111.284 171.816 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -88.58 -31.53 18.57 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.467 0.707 . . . . 73.11 111.648 176.222 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -78.63 -70.17 0.51 Allowed 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.0 0.52 . . . . 74.2 111.105 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 7.2 mpt_? -70.46 -28.62 65.15 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.688 0.795 . . . . 73.41 112.102 178.569 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.16 167.8 35.87 Favored Glycine 0 CA--C 1.536 1.348 0 CA-C-O 119.493 -0.615 . . . . 74.53 112.579 -175.491 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_exo -72.62 87.72 0.94 Allowed 'Trans proline' 0 C--N 1.373 1.841 0 C-N-CA 122.606 2.204 . . . . 65.54 111.956 175.022 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.8 t -135.56 158.36 44.59 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.356 0.662 . . . . 73.12 111.515 -177.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 64.4 p -63.65 -38.66 91.96 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.701 0.8 . . . . 74.14 111.863 177.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 57.8 pttt -73.55 -11.15 60.35 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 123.283 0.633 . . . . 73.0 112.382 177.253 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 56.6 m -78.36 -40.38 36.52 Favored 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 108.97 -0.752 . . . . 74.01 108.97 174.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 49.1 m-85 -65.91 -33.37 75.67 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.673 0.789 . . . . 73.13 111.145 173.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.82 -41.46 83.04 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.361 0.664 . . . . 62.13 111.39 174.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -62.07 -50.4 72.1 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 122.883 0.473 . . . . 75.02 110.59 173.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 59.4 mt -63.33 -23.71 67.54 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 124.84 1.256 . . . . 72.23 112.7 178.627 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . 0.551 ' HA ' ' O ' ' A' ' 48' ' ' LYS . . . -65.59 -50.85 63.6 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.135 0.574 . . . . 73.15 111.45 173.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.79 -28.26 61.56 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-N 115.907 -0.588 . . . . 53.53 111.956 176.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -71.19 -47.38 57.84 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 124.403 1.081 . . . . 75.31 111.585 -176.46 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 75.7 mt -107.34 -0.22 22.6 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.754 0.822 . . . . 71.02 112.701 -172.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 62.0 33.57 17.2 Favored 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 124.571 1.148 . . . . 73.33 112.074 -176.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.551 ' O ' ' HA ' ' A' ' 43' ' ' ALA . 45.6 mmtm -126.48 116.22 20.78 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.811 0.845 . . . . 73.14 109.573 -178.878 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -48.3 148.43 3.26 Favored Pre-proline 0 N--CA 1.502 2.14 0 C-N-CA 123.691 0.797 . . . . 73.32 112.954 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -53.82 -31.67 63.07 Favored 'Trans proline' 0 C--N 1.387 2.557 0 C-N-CA 123.285 2.657 . . . . 74.51 115.041 -168.224 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 25.3 m-80 -63.62 -38.87 92.74 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 123.154 0.582 . . . . 75.32 111.511 178.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -62.41 -43.09 99.65 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.971 0.908 . . . . 75.31 110.229 178.21 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 57.6 t -68.81 -42.68 82.86 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.982 0 CA-C-N 114.261 -1.336 . . . . 75.33 111.716 -177.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 58.0 m -64.19 -36.36 83.79 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.996 0.918 . . . . 63.4 112.789 -177.05 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -63.58 -46.8 84.19 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 122.797 0.439 . . . . 75.31 111.084 175.063 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 17.2 mmt180 -70.67 -27.76 64.27 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 112.708 0.632 . . . . 75.32 112.708 178.227 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.456 ' HE1' ' SG ' ' A' ' 29' ' ' CYS . 22.8 t80 -56.38 -55.52 32.49 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.078 0.551 . . . . 74.53 110.735 175.162 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -71.69 -25.99 62.32 Favored 'General case' 0 CA--C 1.554 1.111 0 CA-C-N 115.232 -0.895 . . . . 73.4 111.637 -178.502 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -72.39 -38.87 68.36 Favored 'General case' 0 CA--C 1.556 1.19 0 C-N-CA 124.818 1.247 . . . . 74.32 109.684 179.198 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.622 ' HB3' HD22 ' A' ' 26' ' ' LEU . 44.3 mt -73.98 -37.43 64.48 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.758 1.223 . . . . 72.03 111.716 177.612 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.437 ' HA ' ' HE2' ' A' ' 61' ' ' MET . 29.4 mmt -64.7 -28.1 69.37 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 122.909 0.484 . . . . 65.34 111.436 174.93 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 57.7 tttm -72.79 -41.97 64.42 Favored 'General case' 0 CA--C 1.557 1.223 0 C-N-CA 123.405 0.682 . . . . 73.24 110.791 175.103 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 93.0 mt -64.02 -32.81 74.49 Favored 'General case' 0 N--CA 1.497 1.89 0 C-N-CA 123.481 0.713 . . . . 72.31 111.246 173.125 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -61.83 -33.53 74.32 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.42 1.088 . . . . 75.02 110.972 179.532 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -72.27 -58.36 3.47 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 123.511 0.725 . . . . 75.31 109.718 169.802 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -178.21 150.15 0.57 Allowed 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 124.635 1.174 . . . . 75.22 109.466 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 69.4 m -70.06 -57.69 4.68 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 122.644 0.378 . . . . 75.24 111.974 -179.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.467 ' HZ2' ' HB3' ' A' ' 68' ' ' LYS . 7.7 mtpm? 60.96 117.8 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.955 0 C-N-CA 125.044 1.338 . . . . 75.4 113.941 177.204 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 60.6 m -95.02 59.62 2.31 Favored 'General case' 0 N--CA 1.485 1.301 0 N-CA-C 109.238 -0.653 . . . . 72.51 109.238 169.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 59.8 mtt-85 . . . . . 0 CA--C 1.564 1.502 0 C-N-CA 125.018 1.327 . . . . 71.42 111.652 -168.272 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 64.4 p . . . . . 0 N--CA 1.49 1.545 0 CA-C-O 120.718 0.294 . . . . 71.11 110.805 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 74.5 t60 61.53 -86.27 0.02 OUTLIER 'General case' 0 CA--C 1.568 1.668 0 C-N-CA 124.822 1.249 . . . . 72.11 111.381 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 59.5 ttm -177.17 -66.27 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 124.57 1.148 . . . . 73.3 109.962 169.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 58.5 tttp 64.82 104.95 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.779 0 C-N-CA 124.76 1.224 . . . . 75.23 112.436 -178.489 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -97.24 -67.1 0.86 Allowed 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 109.064 -0.717 . . . . 74.25 109.064 174.658 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 45.2 t 57.15 87.63 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.559 1.301 0 C-N-CA 124.958 1.303 . . . . 72.13 111.711 -174.216 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.7 mp -76.37 128.61 37.61 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 N-CA-C 109.075 -0.713 . . . . 74.22 109.075 174.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -81.41 131.88 35.3 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.179 0.592 . . . . 75.43 111.075 177.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . 0.444 ' HE3' ' HA ' ' A' ' 9' ' ' LYS . 1.3 tpmt? -93.88 97.88 10.68 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.086 0.554 . . . . 72.21 110.473 176.42 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? -90.52 92.39 8.84 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 122.786 0.434 . . . . 72.12 110.248 178.072 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -81.09 -130.26 1.03 Allowed Glycine 0 CA--C 1.541 1.683 0 CA-C-N 116.332 -0.395 . . . . 72.21 112.258 174.273 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -74.04 141.49 45.76 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-N 117.055 0.427 . . . . 74.43 109.987 171.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.1 pp -63.99 92.51 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.559 1.323 0 CA-C-O 121.657 0.742 . . . . 74.3 111.466 177.231 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 41.9 pt -65.83 -11.81 13.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 C-N-CA 124.539 1.136 . . . . 75.33 111.884 173.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 2.7 mp -58.85 128.51 19.68 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.885 0 C-N-CA 125.04 1.336 . . . . 74.31 110.71 175.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.2 mt -72.81 87.23 1.28 Allowed 'General case' 0 CA--C 1.547 0.834 0 CA-C-O 121.47 0.652 . . . . 73.25 110.429 175.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 90.3 m95 -79.72 112.78 17.32 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 114.96 -1.018 . . . . 74.34 109.907 175.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 37.7 p -103.53 167.37 9.85 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.262 0.625 . . . . 62.41 111.597 -175.22 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.435 ' O ' ' HB2' ' A' ' 23' ' ' ARG . 16.5 ptm180 -62.28 -21.49 65.26 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-N 115.268 -0.878 . . . . 75.11 112.303 174.575 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -77.66 -45.21 25.67 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 123.721 0.808 . . . . 72.15 110.842 174.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.471 ' HA ' HD21 ' A' ' 46' ' ' LEU . 76.7 m-20 -60.26 -58.84 6.8 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.051 0.54 . . . . 62.24 112.079 -176.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -66.87 -30.73 70.97 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 123.498 0.719 . . . . 75.33 111.704 -172.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.435 ' HB2' ' O ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -60.77 -49.61 76.82 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.993 0.917 . . . . 75.23 111.448 175.814 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 89.2 t -69.95 -32.18 50.62 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 CA-C-N 114.587 -1.188 . . . . 74.41 110.889 -179.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 66.4 mt -56.3 -56.28 14.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 C-N-CA 122.491 0.317 . . . . 64.14 110.7 172.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 96.0 mt -58.08 -45.4 87.22 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.317 0.647 . . . . 75.44 112.472 179.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 32.2 tp -64.92 -50.05 67.99 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.094 0.557 . . . . 74.25 112.274 -174.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -78.41 -23.26 46.81 Favored 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 123.033 0.533 . . . . 74.52 112.42 -178.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . 0.525 ' SG ' ' HA ' ' A' ' 34' ' ' PRO . 53.3 t -73.04 -31.46 64.45 Favored 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 122.933 0.493 . . . . 73.11 111.549 177.26 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -87.08 7.4 28.04 Favored 'General case' 0 N--CA 1.486 1.363 0 CA-C-O 120.668 0.27 . . . . 75.31 111.259 173.537 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.628 ' HB2' ' HZ2' ' A' ' 31' ' ' LYS . 4.8 ttmp? -110.03 -53.27 2.69 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 123.871 0.868 . . . . 74.12 111.233 -178.424 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -100.86 9.14 42.7 Favored 'General case' 0 N--CA 1.497 1.889 0 C-N-CA 123.583 0.753 . . . . 73.43 112.22 177.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 87.88 160.39 35.62 Favored Glycine 0 CA--C 1.544 1.881 0 CA-C-O 119.944 -0.365 . . . . 74.34 113.75 -178.606 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.525 ' HA ' ' SG ' ' A' ' 29' ' ' CYS . 53.2 Cg_endo -84.9 40.51 0.84 Allowed 'Trans proline' 0 C--N 1.37 1.687 0 C-N-CA 123.247 2.631 . . . . 63.3 113.691 -177.743 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 47.4 m -107.43 171.64 7.27 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 123.614 0.765 . . . . 70.31 112.384 -175.03 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 88.7 p -61.58 -24.27 66.55 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 123.789 0.835 . . . . 75.4 112.776 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -49.66 -45.27 48.41 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 124.471 1.108 . . . . 74.44 111.68 170.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.473 HG23 ' HA ' ' A' ' 29' ' ' CYS . 17.7 m -88.35 -33.97 17.77 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 114.806 -1.088 . . . . 74.35 110.9 -173.758 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 -67.79 -35.48 78.74 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.004 0.521 . . . . 75.25 112.251 -179.813 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.2 -36.43 69.19 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.387 0.613 . . . . 42.24 111.411 174.37 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 20.9 t80 -59.69 -49.43 77.77 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 124.236 1.014 . . . . 74.11 111.463 172.361 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.452 ' HB2' HG12 ' A' ' 53' ' ' VAL . 59.8 mt -70.52 -26.28 63.51 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 124.308 1.043 . . . . 74.41 112.008 178.698 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.1 -56.32 22.27 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 122.892 0.477 . . . . 75.2 111.327 174.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.57 -28.64 68.69 Favored 'General case' 0 N--CA 1.485 1.296 0 N-CA-C 112.363 0.505 . . . . 62.53 112.363 178.143 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.5 tptp -69.96 -45.79 66.65 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.114 0.565 . . . . 75.14 112.104 178.209 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.529 ' HB2' ' HG2' ' A' ' 48' ' ' LYS . 28.8 mt -99.09 0.94 44.67 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.26 0.624 . . . . 75.11 112.153 -173.605 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 25.8 t70 69.45 26.98 5.06 Favored 'General case' 0 CA--C 1.569 1.709 0 C-N-CA 125.115 1.366 . . . . 74.35 111.831 -178.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.529 ' HG2' ' HB2' ' A' ' 46' ' ' LEU . 63.2 mmtt -101.8 -174.89 2.7 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 123.682 0.793 . . . . 64.41 111.458 179.258 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . 0.417 ' N ' HD21 ' A' ' 49' ' ' ASN . 0.8 OUTLIER -100.13 151.35 37.49 Favored Pre-proline 0 N--CA 1.49 1.557 0 C-N-CA 123.821 0.848 . . . . 71.22 109.285 167.909 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -61.83 -33.53 84.58 Favored 'Trans proline' 0 C--N 1.382 2.306 0 C-N-CA 122.721 2.281 . . . . 74.05 113.35 -176.102 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 -65.99 -39.19 90.1 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.666 0.786 . . . . 70.33 111.538 177.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -69.42 -38.72 78.02 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.489 0.716 . . . . 74.4 111.339 -179.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.452 HG12 ' HB2' ' A' ' 42' ' ' LEU . 95.0 t -65.42 -41.42 91.07 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 C-N-CA 123.436 0.694 . . . . 74.12 110.872 174.382 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.8 t -60.05 -42.33 94.23 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.563 0.745 . . . . 71.24 111.311 176.491 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -64.81 -49.6 70.01 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 115.837 -0.619 . . . . 75.22 111.547 175.024 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.466 ' O ' ' HB2' ' A' ' 60' ' ' LEU . 3.3 tpm_? -57.21 -41.98 80.43 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 122.998 0.519 . . . . 74.22 111.912 -178.002 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -59.07 -54.92 41.58 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.983 0.913 . . . . 74.12 112.24 177.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -73.35 -28.9 62.3 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.012 0.525 . . . . 74.45 111.95 -173.302 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.502 ' O ' ' HG ' ' A' ' 63' ' ' LEU . 56.5 mt-30 -64.72 -46.14 83.55 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 122.947 0.499 . . . . 75.34 110.003 167.011 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.466 ' HB2' ' O ' ' A' ' 56' ' ' ARG . 0.8 OUTLIER -60.38 -38.35 83.66 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 124.256 1.022 . . . . 71.33 111.238 -177.6 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.543 ' HA ' ' HE1' ' A' ' 61' ' ' MET . 21.7 mmt -72.63 -30.26 64.16 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.276 0.631 . . . . 65.21 111.869 176.973 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 53.0 tptt -73.77 -32.74 63.94 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 123.114 0.566 . . . . 73.4 111.105 174.591 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.502 ' HG ' ' O ' ' A' ' 59' ' ' GLN . 80.4 mt -71.96 -42.16 66.9 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.84 0.856 . . . . 74.51 110.5 175.544 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 53.0 t80 -68.72 -26.47 65.28 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 124.494 1.118 . . . . 72.44 110.649 176.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -71.4 -59.19 2.89 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 123.607 0.763 . . . . 72.13 110.69 175.337 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -159.67 122.78 3.57 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.493 0.717 . . . . 74.3 110.417 -177.757 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 53.7 m 69.3 107.92 0.06 Allowed 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 125.171 1.389 . . . . 73.05 112.432 176.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.464 ' HA ' ' HB3' ' A' ' 63' ' ' LEU . 97.2 mttt -86.4 153.44 21.91 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.592 0.757 . . . . 70.03 112.017 178.033 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 46.2 t -84.43 128.93 34.87 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.165 0.586 . . . . 61.14 111.767 -177.123 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 36.0 ttt180 . . . . . 0 CA--C 1.568 1.665 0 C-N-CA 123.599 0.76 . . . . 72.13 111.698 175.157 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 90.3 p . . . . . 0 N--CA 1.49 1.575 0 CA-C-O 120.733 0.301 . . . . 70.14 111.3 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 61.7 m-70 -91.83 51.57 1.86 Allowed 'General case' 0 N--CA 1.49 1.565 0 CA-C-O 121.641 0.734 . . . . 73.12 109.921 178.126 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 26.1 ttt -73.78 113.13 10.57 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 124.527 1.131 . . . . 72.42 112.053 -168.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -112.46 94.0 4.71 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 124.073 0.949 . . . . 74.32 110.764 177.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -82.75 110.44 17.79 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.145 0.578 . . . . 72.31 110.57 177.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 43.8 t -72.66 86.64 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.116 0 CA-C-O 121.729 0.776 . . . . 75.54 109.889 179.379 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 11.2 tt -98.46 104.74 16.34 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.178 0 CA-C-N 115.244 -0.889 . . . . 74.5 111.161 -175.245 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 50.3 mtmt -123.46 62.71 1.03 Allowed 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.865 0.866 . . . . 75.55 109.126 174.847 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -84.87 -20.08 31.37 Favored 'General case' 0 N--CA 1.485 1.284 0 CA-C-N 115.189 -0.914 . . . . 74.25 111.7 178.523 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -155.72 125.97 6.68 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.892 0.877 . . . . 73.55 109.686 -174.407 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -75.07 77.2 1.17 Allowed Glycine 0 C--N 1.348 1.244 0 O-C-N 123.378 0.424 . . . . 61.34 113.331 179.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -107.12 154.48 21.1 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.731 0.813 . . . . 73.11 109.905 177.462 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.6 mp -73.91 -31.57 31.17 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 C-N-CA 123.393 0.677 . . . . 73.24 111.386 -174.813 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 61.2 mt 63.18 80.8 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.064 0 C-N-CA 124.712 1.205 . . . . 75.23 109.64 -171.325 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.619 HD11 ' HA ' ' A' ' 52' ' ' GLN . 52.4 mt 64.01 106.02 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 125.239 1.416 . . . . 75.21 111.587 -176.207 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 48.2 tp -73.36 113.31 10.3 Favored 'General case' 0 CA--C 1.551 1.018 0 CA-C-O 121.282 0.563 . . . . 74.52 112.283 -173.812 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . 0.522 ' HE1' ' HG3' ' A' ' 56' ' ' ARG . 98.6 m95 -126.2 173.97 8.86 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.715 1.206 . . . . 75.12 110.434 171.502 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 14.0 p -103.8 160.91 14.38 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 108.382 -0.97 . . . . 62.14 108.382 164.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 36.7 ptt-85 -57.0 -26.05 59.58 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 123.309 0.644 . . . . 73.31 111.886 177.352 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.415 ' O ' HG22 ' A' ' 24' ' ' VAL . 22.3 m-80 -75.52 -37.25 60.21 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.016 0.927 . . . . 75.45 110.911 -179.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -68.37 -47.71 66.68 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 112.961 0.726 . . . . 73.45 112.961 -177.487 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -65.54 -30.36 71.1 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 120.872 0.368 . . . . 72.03 111.38 176.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -62.32 -44.29 96.84 Favored 'General case' 0 N--CA 1.484 1.226 0 CA-C-N 116.421 -0.354 . . . . 73.04 111.053 168.717 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.415 HG22 ' O ' ' A' ' 20' ' ' ASN . 68.1 t -63.17 -34.28 65.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 C-N-CA 123.351 0.66 . . . . 74.03 111.169 176.676 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 88.0 mt -61.32 -44.03 97.7 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.502 0 C-N-CA 122.581 0.353 . . . . 72.23 111.222 173.762 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.444 ' HG ' HD12 ' A' ' 60' ' ' LEU . 94.0 mt -72.19 -28.53 63.26 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.609 0.764 . . . . 72.21 112.537 174.644 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 47.5 tp -68.01 -52.01 40.53 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 124.211 1.004 . . . . 73.34 110.325 178.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -76.97 -16.21 59.41 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 114.922 -1.035 . . . . 64.43 112.018 178.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 46.1 t -60.61 -32.85 71.97 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 123.076 0.55 . . . . 74.43 111.842 167.131 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 9.6 mm100 -91.14 -18.21 24.86 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 122.686 0.394 . . . . 75.01 110.973 176.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 54.1 tptt -74.67 -34.15 62.62 Favored 'General case' 0 CA--C 1.559 1.307 0 C-N-CA 124.09 0.956 . . . . 74.01 110.801 174.15 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 2.8 mpt_? -126.14 -73.77 0.62 Allowed 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.81 0.844 . . . . 74.13 110.561 174.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 150.37 167.33 14.31 Favored Glycine 0 N--CA 1.479 1.566 0 CA-C-O 119.056 -0.858 . . . . 72.35 111.574 -172.062 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.27 74.89 2.46 Favored 'Trans proline' 0 CA--C 1.564 1.991 0 CA-C-N 120.49 2.145 . . . . 72.41 112.363 173.138 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 42.5 t -123.38 164.18 19.36 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 124.302 1.041 . . . . 74.52 111.671 -173.211 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 79.8 p -62.94 -40.62 98.22 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 124.391 1.076 . . . . 64.25 111.621 179.531 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -66.25 -25.76 67.04 Favored 'General case' 0 N--CA 1.485 1.315 0 CA-C-N 115.541 -0.754 . . . . 75.11 112.072 176.075 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 20.8 m -83.87 -32.24 25.3 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.388 0.675 . . . . 74.52 110.394 -177.092 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -61.23 -40.22 93.2 Favored 'General case' 0 CA--C 1.555 1.156 0 C-N-CA 122.84 0.456 . . . . 74.22 110.304 170.374 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.71 -34.72 62.66 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.04 0.936 . . . . 73.3 111.957 177.479 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -64.84 -46.26 82.65 Favored 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 124.19 0.996 . . . . 73.54 110.989 177.19 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.444 ' HB2' HG12 ' A' ' 53' ' ' VAL . 42.7 mt -73.61 -25.61 60.41 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.417 1.087 . . . . 72.21 112.259 175.42 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.91 -42.64 94.56 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-O 120.872 0.368 . . . . 72.12 110.576 171.027 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -71.07 -36.93 72.45 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.682 0.793 . . . . 72.43 112.133 176.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 9.0 tmtm? -77.1 -41.62 41.37 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.908 0.883 . . . . 70.12 111.583 -174.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.441 ' HB3' ' HZ3' ' A' ' 17' ' ' TRP . 83.8 mt -99.6 -1.6 37.74 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.482 0.713 . . . . 71.21 112.02 -176.328 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 36.7 t70 55.58 65.2 1.53 Allowed 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 124.868 1.267 . . . . 73.42 112.815 179.43 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.43 ' HG3' ' CH2' ' A' ' 17' ' ' TRP . 68.1 mmtt -141.48 175.86 9.34 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 124.864 1.265 . . . . 74.03 109.922 172.643 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 65.2 m-80 -75.23 149.59 84.72 Favored Pre-proline 0 CA--C 1.559 1.291 0 N-CA-C 110.158 -0.312 . . . . 74.11 110.158 168.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -54.86 -29.66 64.39 Favored 'Trans proline' 0 C--N 1.387 2.571 0 C-N-CA 122.998 2.465 . . . . 65.11 114.482 -178.256 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -65.16 -41.02 95.08 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 123.612 0.765 . . . . 74.22 111.561 176.539 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.619 ' HA ' HD11 ' A' ' 15' ' ' ILE . 76.7 mm-40 -64.89 -36.79 85.51 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.427 0.691 . . . . 75.43 111.179 -176.878 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . 0.444 HG12 ' HB2' ' A' ' 42' ' ' LEU . 82.4 t -72.51 -50.78 32.51 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.951 0 CA-C-N 115.161 -0.927 . . . . 73.13 111.045 172.391 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 46.6 t -60.16 -49.47 77.49 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 124.388 1.075 . . . . 74.41 112.884 -169.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.449 ' O ' ' HG2' ' A' ' 59' ' ' GLN . 31.4 mm-40 -56.51 -47.71 78.76 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.412 0.685 . . . . 64.13 111.833 177.703 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.522 ' HG3' ' HE1' ' A' ' 17' ' ' TRP . 10.1 mmm180 -71.91 -28.15 63.29 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.731 0.812 . . . . 74.2 112.843 -179.125 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -66.87 -41.29 87.51 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 108.716 -0.846 . . . . 65.55 108.716 173.302 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.411 ' O ' ' HG3' ' A' ' 62' ' ' LYS . 53.4 mt-30 -69.33 -29.65 67.53 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 115.356 -0.838 . . . . 72.24 111.642 175.826 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . 0.449 ' HG2' ' O ' ' A' ' 55' ' ' GLU . 13.3 mm100 -66.99 -41.58 86.5 Favored 'General case' 0 N--CA 1.49 1.57 0 CA-C-O 121.203 0.525 . . . . 73.53 109.832 176.071 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.444 HD12 ' HG ' ' A' ' 26' ' ' LEU . 69.2 mt -59.57 -43.76 93.5 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 114.989 -1.005 . . . . 74.44 111.059 174.225 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 23.6 mmt -65.78 -29.89 70.45 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.266 0.626 . . . . 73.53 112.325 176.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.411 ' HG3' ' O ' ' A' ' 58' ' ' GLN . 95.9 mttt -70.39 -31.91 69.33 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.392 0.677 . . . . 75.05 111.094 173.396 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 85.6 mt -67.6 -39.6 84.78 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.024 0.529 . . . . 74.13 111.082 174.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -72.92 -31.18 64.46 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 123.129 0.572 . . . . 70.42 111.861 174.435 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -60.3 -58.43 8.55 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.654 0.781 . . . . 73.41 111.094 -179.411 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.68 -45.01 22.33 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 122.748 0.419 . . . . 75.13 110.078 -179.834 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 23.2 t 65.75 27.48 11.19 Favored 'General case' 0 N--CA 1.497 1.917 0 C-N-CA 124.352 1.061 . . . . 72.32 111.571 -176.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -74.36 90.76 2.16 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-O 121.167 0.508 . . . . 75.43 109.885 176.067 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 66.0 m -86.58 87.67 7.49 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-O 121.273 0.559 . . . . 64.35 110.316 179.545 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . 0.405 ' H ' ' HG3' ' A' ' 70' ' ' ARG . 0.3 OUTLIER . . . . . 0 CA--C 1.574 1.899 0 C-N-CA 124.201 1.0 . . . . 74.23 113.085 -178.442 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 45.0 t . . . . . 0 N--CA 1.491 1.59 0 N-CA-C 110.888 -0.041 . . . . 75.32 110.888 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 77.9 m-70 -70.75 112.29 6.85 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 122.908 0.483 . . . . 75.45 111.356 177.114 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 27.3 ttt -163.64 -65.38 0.04 OUTLIER 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.048 0.939 . . . . 72.33 109.532 176.365 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 61.17 98.76 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 124.637 1.175 . . . . 75.0 112.626 176.402 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -70.02 -31.67 69.45 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 122.87 0.468 . . . . 62.11 110.844 173.056 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 98.2 t 60.65 98.68 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 C-N-CA 124.935 1.294 . . . . 74.51 113.029 174.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 9.9 tt -70.85 -52.33 28.9 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.25 0 N-CA-C 109.571 -0.529 . . . . 73.44 109.571 167.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.1 mtpt -144.99 160.93 40.56 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 125.059 1.344 . . . . 75.44 109.116 176.593 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -160.27 -40.08 0.05 Allowed 'General case' 0 N--CA 1.496 1.835 0 CA-C-N 118.25 0.477 . . . . 74.33 112.266 -173.269 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.84 150.71 44.2 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 113.277 0.843 . . . . 71.42 113.277 -172.235 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 137.66 175.22 13.74 Favored Glycine 0 N--CA 1.475 1.26 0 CA-C-N 115.533 -0.758 . . . . 55.34 112.75 -174.345 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 -90.14 93.44 9.37 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 122.868 0.467 . . . . 73.22 111.421 178.318 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.3 mp -77.49 127.72 38.22 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 N-CA-C 108.234 -1.024 . . . . 75.12 108.234 171.639 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.1 mp -78.49 85.06 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.871 0 N-CA-C 108.565 -0.902 . . . . 75.11 108.565 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.6 HG13 ' HG2' ' A' ' 52' ' ' GLN . 48.5 mm 72.81 142.9 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.564 1.519 0 C-N-CA 125.414 1.486 . . . . 74.32 112.987 176.378 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -70.89 84.28 0.67 Allowed 'General case' 0 CA--C 1.559 1.31 0 C-N-CA 124.43 1.092 . . . . 75.24 110.262 -178.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 80.8 m95 -98.12 115.06 27.5 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.462 0.705 . . . . 74.23 111.434 179.479 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 58.2 p -107.58 166.11 10.92 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.333 0.653 . . . . 71.2 110.949 177.282 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 17.1 ptp180 -57.91 -21.16 42.09 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 124.198 0.999 . . . . 72.11 112.276 174.015 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -76.58 -46.04 27.86 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 124.084 0.954 . . . . 73.14 110.724 174.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 39.2 m-20 -59.7 -57.03 14.67 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.25 0.62 . . . . 75.22 111.735 178.685 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.567 ' HB2' HD22 ' A' ' 60' ' ' LEU . 2.6 p30 -64.97 -31.74 73.13 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 113.209 0.818 . . . . 73.3 113.209 -174.916 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 48.2 ttt180 -62.28 -42.11 99.06 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 122.893 0.477 . . . . 73.52 111.018 175.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.464 ' HB ' HD22 ' A' ' 46' ' ' LEU . 92.7 t -71.36 -33.09 48.95 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 C-N-CA 123.455 0.702 . . . . 73.34 111.487 177.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 94.5 mt -57.65 -57.38 10.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 CA-C-O 120.886 0.374 . . . . 64.31 110.278 172.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.448 ' HG ' HD12 ' A' ' 60' ' ' LEU . 90.6 mt -61.89 -33.28 73.94 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 115.636 -0.711 . . . . 71.21 112.174 178.656 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 56.0 tp -61.76 -54.46 42.08 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.803 0.841 . . . . 75.1 111.533 179.047 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.497 ' HA ' ' HB3' ' A' ' 31' ' ' LYS . 59.3 mm-40 -75.13 -22.94 57.85 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 113.045 0.757 . . . . 75.23 113.045 -178.679 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 89.6 m -69.83 -30.13 67.56 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 122.775 0.43 . . . . 72.14 111.307 171.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -91.92 -20.38 21.47 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.346 0.658 . . . . 71.25 111.882 173.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.497 ' HB3' ' HA ' ' A' ' 28' ' ' GLU . 58.8 tptt -80.66 -67.21 0.79 Allowed 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.641 0.777 . . . . 73.1 110.545 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 45.2 mtt85 -92.51 -40.38 10.85 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.03 0.932 . . . . 72.03 111.74 -178.34 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 138.48 163.07 9.43 Favored Glycine 0 N--CA 1.481 1.658 0 CA-C-O 119.528 -0.596 . . . . 73.22 112.556 -178.384 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -83.2 36.37 0.61 Allowed 'Trans proline' 0 CA--C 1.561 1.858 0 C-N-CA 123.017 2.478 . . . . 71.04 113.815 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 79.1 p -80.59 161.44 24.73 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.589 0.756 . . . . 75.24 111.732 -177.745 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 99.0 p -67.05 -23.77 65.91 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.04 0.536 . . . . 74.53 111.587 174.745 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -69.8 -32.04 70.28 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.531 0.732 . . . . 65.13 111.492 173.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 86.3 m -78.04 -37.17 47.45 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.048 0.539 . . . . 72.31 109.636 178.228 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -64.7 -32.08 73.59 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.405 0.682 . . . . 73.42 111.39 172.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.62 -39.51 88.36 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 123.415 0.686 . . . . 74.33 111.26 173.527 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -63.05 -49.16 75.67 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.264 0.625 . . . . 73.22 110.797 172.087 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 77.9 mt -63.62 -23.76 67.52 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 124.79 1.236 . . . . 73.54 113.032 -179.652 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.75 -55.03 34.52 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 123.088 0.555 . . . . 70.11 110.998 170.295 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.67 -27.83 62.34 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.586 0.754 . . . . 72.32 112.351 179.223 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -75.91 -39.02 57.1 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.184 0.993 . . . . 75.01 111.325 -177.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.464 HD22 ' HB ' ' A' ' 24' ' ' VAL . 91.0 mt -106.26 12.75 29.66 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.759 0.824 . . . . 74.02 112.687 -177.312 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.0 p30 51.37 23.95 1.95 Allowed 'General case' 0 N--CA 1.501 2.117 0 C-N-CA 125.548 1.539 . . . . 75.43 114.09 -174.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -106.82 -175.01 2.67 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 123.615 0.766 . . . . 71.42 111.565 -178.221 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 47.5 m-80 -96.55 143.84 26.82 Favored Pre-proline 0 N--CA 1.492 1.628 0 C-N-CA 123.084 0.554 . . . . 74.14 110.431 173.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -66.24 -26.74 48.96 Favored 'Trans proline' 0 C--N 1.379 2.137 0 C-N-CA 122.653 2.235 . . . . 72.14 113.512 -171.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -71.76 -38.77 70.33 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.46 0.704 . . . . 74.32 111.32 178.264 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.6 ' HG2' HG13 ' A' ' 15' ' ' ILE . 12.0 mp0 -70.75 -35.14 72.5 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.174 0.59 . . . . 73.34 110.849 176.742 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 86.1 t -62.4 -47.36 93.37 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 C-N-CA 123.375 0.67 . . . . 72.13 111.26 174.475 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 90.9 p -65.67 -41.7 92.18 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.35 0.66 . . . . 74.11 112.161 -177.239 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -64.92 -48.97 72.25 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 122.675 0.39 . . . . 72.42 111.63 177.018 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.454 ' NH1' ' HB3' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -70.08 -23.98 63.16 Favored 'General case' 0 CA--C 1.561 1.368 0 C-N-CA 123.313 0.645 . . . . 72.53 111.215 -177.079 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.469 ' HA ' HD13 ' A' ' 60' ' ' LEU . 23.9 t80 -61.13 -49.29 77.86 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 123.979 0.912 . . . . 75.1 111.556 170.71 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -73.88 -24.42 59.73 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 115.465 -0.789 . . . . 74.25 111.143 -178.801 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -72.35 -32.81 66.79 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.58 0.752 . . . . 75.24 111.102 171.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.567 HD22 ' HB2' ' A' ' 22' ' ' ASP . 15.3 mt -58.58 -55.54 33.79 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.415 0.686 . . . . 72.3 111.142 173.218 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.46 ' HA ' ' HE2' ' A' ' 61' ' ' MET . 27.9 mmt -63.4 -31.06 72.12 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.015 0.526 . . . . 73.41 112.018 178.844 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -64.01 -46.37 84.82 Favored 'General case' 0 CA--C 1.556 1.209 0 C-N-CA 123.498 0.719 . . . . 74.15 111.389 174.418 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 97.3 mt -72.02 -41.12 67.91 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.496 0.718 . . . . 72.14 112.09 -179.115 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -67.96 -16.2 63.95 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 123.367 0.667 . . . . 70.44 112.631 -179.294 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -66.49 -33.6 76.05 Favored 'General case' 0 CA--C 1.561 1.397 0 C-N-CA 122.484 0.314 . . . . 64.14 111.09 170.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 64.4 pttt -114.21 7.68 16.63 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 112.685 0.624 . . . . 73.42 112.685 178.611 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 58.6 m -74.98 128.55 35.83 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 122.025 -0.422 . . . . 73.43 110.896 175.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 90.9 mttt -74.55 104.86 5.41 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.573 0.749 . . . . 73.34 110.562 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 76.6 m -79.02 16.66 0.88 Allowed 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 123.906 0.883 . . . . 64.43 113.234 -176.098 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 55.2 ttt180 . . . . . 0 CA--C 1.558 1.287 0 C-N-CA 123.944 0.898 . . . . 74.22 109.323 176.461 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 90.9 m95 . . . . . 0 N--CA 1.487 1.421 0 N-CA-C 110.389 -0.226 . . . . 74.31 110.389 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 44.8 p -126.16 169.44 12.83 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.117 0.567 . . . . 65.02 111.201 179.338 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -51.9 -33.11 35.45 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 124.831 1.252 . . . . 74.32 114.063 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.405 ' O ' HG23 ' A' ' 24' ' ' VAL . 14.6 t-20 -73.52 -34.73 65.38 Favored 'General case' 0 CA--C 1.558 1.267 0 C-N-CA 123.094 0.558 . . . . 71.44 111.244 -176.755 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -69.71 -52.38 26.07 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.307 0.643 . . . . 73.01 112.013 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -58.83 -31.63 68.65 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.852 0.861 . . . . 64.53 112.549 -178.843 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 74.4 ttt180 -62.59 -46.2 89.41 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 122.29 0.236 . . . . 71.42 111.068 174.145 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 20' ' ' ASN . 36.8 t -63.37 -39.15 84.21 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 C-N-CA 123.253 0.621 . . . . 74.4 111.092 -179.087 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.417 ' HA ' HD13 ' A' ' 42' ' ' LEU . 87.0 mt -54.81 -57.79 5.79 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.238 0 C-N-CA 123.225 0.61 . . . . 73.13 110.95 175.794 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 94.2 mt -63.05 -34.07 76.79 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.399 0.68 . . . . 55.21 112.142 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 31.7 tp -65.01 -53.39 46.9 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.428 0.691 . . . . 75.43 111.626 -177.259 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 48.1 mm-40 -75.76 -24.63 56.08 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 122.846 0.458 . . . . 74.12 112.2 179.122 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 41.5 t -68.94 -38.5 79.51 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 122.677 0.391 . . . . 64.41 111.364 177.15 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -80.75 -35.18 33.67 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.232 0.613 . . . . 73.35 111.203 177.184 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -64.28 -47.15 80.64 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 123.531 0.732 . . . . 71.41 111.852 177.313 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 36.8 mtt180 -104.6 -68.21 0.86 Allowed 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.649 0.78 . . . . 72.01 110.719 -173.679 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 145.81 135.51 2.81 Favored Glycine 0 CA--C 1.534 1.227 0 CA-C-O 118.885 -0.953 . . . . 74.33 110.912 -172.024 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -66.76 87.75 0.29 Allowed 'Trans proline' 0 CA--C 1.561 1.872 0 C-N-CA 122.716 2.278 . . . . 72.23 113.342 -178.825 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 98.7 p -126.55 163.45 23.38 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.128 0.971 . . . . 71.52 110.149 178.312 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 68.8 p -55.15 -39.82 69.9 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 123.953 0.901 . . . . 71.23 113.027 -179.39 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 63.7 pttt -73.76 -25.98 60.42 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.496 0.718 . . . . 73.52 112.335 179.669 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 86.4 m -76.1 -39.56 54.98 Favored 'General case' 0 N--CA 1.484 1.24 0 N-CA-C 108.87 -0.789 . . . . 52.02 108.87 175.556 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -67.16 -28.83 68.45 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 115.322 -0.854 . . . . 72.25 111.254 173.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.09 -35.95 66.71 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.749 0.82 . . . . 65.32 111.863 175.097 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -62.71 -50.37 71.39 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.184 0.594 . . . . 72.31 110.406 171.724 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.439 ' HB2' HG11 ' A' ' 53' ' ' VAL . 76.3 mt -66.21 -25.64 67.02 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.555 1.142 . . . . 70.04 112.192 177.229 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.39 -58.48 5.2 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.315 0.646 . . . . 64.03 111.117 175.284 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.84 -36.15 76.23 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 123.5 0.72 . . . . 51.41 111.945 178.277 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.25 -49.75 70.67 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 124.175 0.99 . . . . 74.1 111.81 176.217 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 52.3 mt -99.5 14.6 29.32 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 113.196 0.813 . . . . 65.31 113.196 -170.819 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 68.25 13.96 9.14 Favored 'General case' 0 N--CA 1.508 2.434 0 C-N-CA 125.071 1.349 . . . . 74.01 113.211 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -103.48 -176.72 3.16 Favored 'General case' 0 N--CA 1.483 1.182 0 CA-C-O 121.768 0.794 . . . . 52.42 112.843 -173.549 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -102.76 153.91 37.88 Favored Pre-proline 0 CA--C 1.559 1.296 0 CA-C-N 115.003 -0.999 . . . . 52.42 109.421 166.484 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_exo -47.11 -35.12 18.7 Favored 'Trans proline' 0 C--N 1.388 2.645 0 C-N-CA 123.623 2.882 . . . . 73.43 114.631 177.174 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.41 ' O ' ' HG3' ' A' ' 55' ' ' GLU . 78.8 m-20 -59.63 -50.55 73.42 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.613 0.765 . . . . 75.5 111.585 176.84 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 83.1 mm-40 -55.83 -46.43 78.13 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 123.56 0.744 . . . . 74.22 112.111 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.439 HG11 ' HB2' ' A' ' 42' ' ' LEU . 76.8 t -64.74 -45.78 94.14 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 CA-C-N 115.163 -0.926 . . . . 60.25 111.631 -178.899 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.3 t -59.47 -44.13 93.08 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.303 0.641 . . . . 62.32 111.941 179.604 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.418 ' O ' ' HG2' ' A' ' 59' ' ' GLN . 60.0 mt-10 -57.78 -50.82 71.97 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.127 0.571 . . . . 73.43 111.435 177.693 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 40.3 mmt-85 -68.78 -35.2 76.75 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 122.677 0.391 . . . . 74.23 111.908 -176.655 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -52.77 -52.77 55.25 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.422 0.689 . . . . 54.24 110.964 170.561 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -69.61 -25.14 63.81 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 115.337 -0.847 . . . . 44.42 112.133 -176.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.418 ' HG2' ' O ' ' A' ' 55' ' ' GLU . 30.9 mm-40 -68.56 -54.42 16.74 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 109.373 -0.602 . . . . 61.1 109.373 172.406 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 21.0 mt -47.61 -48.02 28.53 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 125.02 1.328 . . . . 63.41 112.607 179.015 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 23.7 mmt . . . . . 0 N--CA 1.487 1.423 0 C-N-CA 123.297 0.639 . . . . 72.43 111.667 178.064 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 97.3 m95 . . . . . 0 N--CA 1.484 1.254 0 N-CA-C 110.195 -0.298 . . . . 74.34 110.195 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 30.7 p -135.38 168.57 18.97 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 124.137 0.975 . . . . 60.11 110.448 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 14.5 ptm180 -57.9 -28.33 64.12 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 113.976 1.102 . . . . 73.51 113.976 -171.736 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -68.82 -34.53 75.66 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.263 0.625 . . . . 65.24 111.463 178.002 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.418 ' HA ' HD22 ' A' ' 46' ' ' LEU . 47.8 m-20 -66.48 -57.7 6.79 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.003 0.521 . . . . 74.45 110.718 175.218 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -54.26 -39.01 66.46 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.506 1.122 . . . . 73.11 112.781 -179.471 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 61.3 ttt-85 -60.1 -50.33 74.13 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.191 0.597 . . . . 75.34 111.938 178.392 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 38.4 t -75.0 -31.71 25.63 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 122.708 0.403 . . . . 63.4 111.048 -174.154 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 75.1 mt -60.84 -48.57 88.32 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 C-N-CA 122.146 0.178 . . . . 65.5 110.621 172.97 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 96.3 mt -66.62 -34.8 78.67 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 123.186 0.594 . . . . 72.42 112.317 177.452 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 64.2 tp -61.87 -48.08 82.13 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.66 0.784 . . . . 74.2 111.298 177.657 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.55 ' HB3' HG23 ' A' ' 38' ' ' THR . 26.4 mm-40 -72.56 -32.42 66.04 Favored 'General case' 0 CA--C 1.551 0.988 0 CA-C-N 114.767 -1.106 . . . . 73.25 112.088 176.284 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.667 ' HG ' ' HE1' ' A' ' 57' ' ' PHE . 13.9 t -65.45 -35.46 80.98 Favored 'General case' 0 N--CA 1.491 1.598 0 C-N-CA 123.714 0.805 . . . . 73.32 112.212 179.478 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -90.39 -3.95 57.37 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.057 0.543 . . . . 55.33 111.963 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 27.0 tptp -113.15 -73.3 0.67 Allowed 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 123.123 0.569 . . . . 71.23 110.74 178.524 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 61.5 mtt180 -81.21 -10.61 59.58 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.257 0.623 . . . . 64.41 112.435 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 82.21 -165.22 44.8 Favored Glycine 0 CA--C 1.538 1.529 0 N-CA-C 114.611 0.604 . . . . 52.21 114.611 173.909 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -82.39 35.78 0.59 Allowed 'Trans proline' 0 C--N 1.374 1.906 0 C-N-CA 123.54 2.827 . . . . 60.23 113.557 176.723 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 65.4 m -76.34 152.66 36.29 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.166 0.586 . . . . 65.15 112.182 -177.651 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 87.5 p -63.7 -30.09 71.23 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 123.252 0.621 . . . . 73.4 110.462 168.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -55.37 -40.04 70.83 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 124.417 1.087 . . . . 63.2 110.977 170.568 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.55 HG23 ' HB3' ' A' ' 28' ' ' GLU . 32.2 m -75.76 -47.32 26.41 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 114.827 -1.079 . . . . 51.52 109.414 -174.248 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 21.1 m-85 -63.71 -30.43 71.53 Favored 'General case' 0 CA--C 1.551 0.997 0 CA-C-N 114.802 -1.09 . . . . 74.52 112.042 178.254 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.79 -42.57 77.16 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.421 0.688 . . . . 71.24 111.341 175.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -61.28 -55.75 28.38 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 122.791 0.436 . . . . 62.43 110.522 174.909 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.402 ' HB2' HG11 ' A' ' 53' ' ' VAL . 72.8 mt -61.47 -25.65 67.38 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.486 1.115 . . . . 60.43 113.107 -178.173 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.47 -56.13 18.6 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-O 121.153 0.502 . . . . 55.02 111.231 173.085 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -71.66 -30.63 65.94 Favored 'General case' 0 N--CA 1.482 1.174 0 CA-C-N 116.014 -0.539 . . . . 62.41 112.213 -178.891 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 8.5 tmtm? -73.91 -53.78 9.4 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.988 0.915 . . . . 75.12 110.659 -176.36 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.418 HD22 ' HA ' ' A' ' 21' ' ' ASP . 88.3 mt -86.73 3.06 46.48 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.262 0.625 . . . . 71.53 112.67 -175.667 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.0 t70 60.5 34.21 20.44 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-O 122.372 1.082 . . . . 61.34 110.666 -175.336 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 47.5 mmtm -107.17 -177.86 3.48 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 115.0 -1.0 . . . . 64.12 111.291 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ASN . . . . . 0.454 ' HB2' ' HG3' ' A' ' 52' ' ' GLN . 2.2 m120 -105.37 148.28 36.03 Favored Pre-proline 0 CA--C 1.554 1.131 0 N-CA-C 108.84 -0.8 . . . . 72.32 108.84 172.445 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_exo -53.4 -34.95 73.53 Favored 'Trans proline' 0 C--N 1.384 2.441 0 C-N-CA 122.746 2.297 . . . . 74.43 114.329 178.82 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 23.8 m120 -68.06 -44.72 75.69 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.654 0.382 . . . . 72.22 111.267 174.891 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.454 ' HG3' ' HB2' ' A' ' 49' ' ' ASN . 96.5 mt-30 -57.75 -45.4 85.93 Favored 'General case' 0 N--CA 1.494 1.73 0 C-N-CA 123.037 0.535 . . . . 54.22 111.393 176.25 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.402 HG11 ' HB2' ' A' ' 42' ' ' LEU . 87.9 t -63.83 -50.88 75.7 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.896 0 C-N-CA 123.717 0.807 . . . . 71.12 111.628 -179.856 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.447 ' O ' ' HG3' ' A' ' 58' ' ' GLN . 90.2 p -60.78 -43.41 98.13 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.185 0.594 . . . . 54.13 112.21 -176.313 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.437 ' O ' ' HG2' ' A' ' 59' ' ' GLN . 44.0 mt-10 -67.05 -43.66 82.16 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.148 0.579 . . . . 71.44 111.871 178.427 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 22.1 tpt180 -62.9 -39.95 96.1 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 123.137 0.575 . . . . 74.23 111.396 177.434 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.667 ' HE1' ' HG ' ' A' ' 29' ' ' CYS . 3.5 t80 -52.37 -48.3 65.67 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.547 1.139 . . . . 74.42 111.045 172.365 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.447 ' HG3' ' O ' ' A' ' 54' ' ' SER . 49.6 mt-30 -66.74 -34.51 78.0 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 115.851 -0.613 . . . . 74.12 111.532 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.437 ' HG2' ' O ' ' A' ' 55' ' ' GLU . 11.7 mm-40 -69.96 -33.36 71.99 Favored 'General case' 0 N--CA 1.486 1.345 0 CA-C-O 120.893 0.378 . . . . 72.14 110.579 177.905 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 32.8 mt -62.38 -41.91 99.0 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.059 0.944 . . . . 74.21 111.331 170.823 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 34.5 mmt . . . . . 0 N--CA 1.489 1.482 0 C-N-CA 123.388 0.675 . . . . 74.4 111.057 175.02 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 79.3 m95 . . . . . 0 N--CA 1.478 0.934 0 N-CA-C 109.851 -0.426 . . . . 74.41 109.851 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 19.4 p -108.48 168.29 9.43 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 122.245 -0.284 . . . . 74.41 110.684 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 24.1 ptt-85 -53.85 -21.78 8.38 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 124.401 1.081 . . . . 65.33 112.912 176.252 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.402 ' O ' HG23 ' A' ' 24' ' ' VAL . 22.8 m-80 -74.14 -49.6 23.04 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.359 0.664 . . . . 74.2 110.329 175.289 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -60.29 -58.95 6.34 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.895 0.878 . . . . 71.02 111.768 -178.653 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.612 ' HB2' HD21 ' A' ' 60' ' ' LEU . 2.1 p30 -66.2 -31.67 72.63 Favored 'General case' 0 CA--C 1.558 1.282 0 N-CA-C 113.268 0.84 . . . . 74.42 113.268 -172.492 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 34.9 ttt180 -60.23 -44.06 95.52 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 123.487 0.715 . . . . 73.31 111.64 173.615 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.402 HG23 ' O ' ' A' ' 20' ' ' ASN . 80.3 t -66.52 -37.61 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 C-N-CA 123.225 0.61 . . . . 44.44 111.201 177.869 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 78.1 mt -58.13 -56.2 17.45 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 122.749 0.42 . . . . 71.25 111.151 176.325 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.584 ' HG ' HD13 ' A' ' 60' ' ' LEU . 78.5 mt -57.99 -37.32 74.02 Favored 'General case' 0 N--CA 1.484 1.231 0 N-CA-C 112.322 0.49 . . . . 55.31 112.322 179.148 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 46.4 tp -63.65 -51.56 64.63 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.591 0.756 . . . . 74.34 112.447 -178.703 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -77.97 -22.24 49.72 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 112.679 0.622 . . . . 74.53 112.679 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 80.3 m -75.35 -41.66 56.05 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 112.215 0.45 . . . . 74.32 112.215 177.678 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -70.14 -29.25 66.13 Favored 'General case' 0 N--CA 1.491 1.625 0 C-N-CA 122.711 0.404 . . . . 60.42 111.204 175.404 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -73.98 -66.9 0.66 Allowed 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 124.045 0.938 . . . . 63.21 111.212 177.728 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 60.7 mtt-85 -80.41 -56.85 3.9 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.193 0.997 . . . . 73.24 111.328 -171.683 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 129.71 154.78 8.23 Favored Glycine 0 CA--C 1.538 1.523 0 CA-C-O 119.356 -0.691 . . . . 72.32 112.499 -177.807 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_exo -65.46 94.3 0.25 Allowed 'Trans proline' 0 C--N 1.377 2.042 0 C-N-CA 123.27 2.647 . . . . 74.43 112.684 176.73 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 67.3 m -142.24 155.64 45.26 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 124.07 0.948 . . . . 74.13 110.587 -178.594 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 91.2 p -59.92 -40.31 88.43 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 123.319 0.647 . . . . 63.42 112.411 -176.909 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 38.6 mtmm -68.37 -24.41 64.79 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.041 0.537 . . . . 73.14 112.337 176.801 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 68.5 m -78.19 -43.05 29.59 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 109.225 -0.657 . . . . 64.32 109.225 -179.544 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -72.07 -29.19 63.89 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 115.267 -0.879 . . . . 72.43 111.563 176.696 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.15 -34.72 61.65 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.518 0.727 . . . . 74.02 111.329 174.424 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 86.2 t80 -63.91 -48.53 76.25 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 122.995 0.518 . . . . 71.23 110.392 172.552 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.445 ' HB2' HG11 ' A' ' 53' ' ' VAL . 81.7 mt -66.36 -27.28 67.76 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.26 1.024 . . . . 70.52 112.109 176.255 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.83 -42.32 86.02 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.074 0.55 . . . . 54.23 111.207 172.36 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.42 -34.88 68.17 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.157 0.583 . . . . 61.31 111.478 175.702 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 58.8 tptt -67.21 -40.25 86.41 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.843 1.257 . . . . 71.2 111.358 -179.516 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 46.8 mt -109.26 12.23 24.96 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.807 0.843 . . . . 73.12 112.263 -175.518 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.7 p30 49.49 22.77 0.78 Allowed 'General case' 0 N--CA 1.51 2.527 0 C-N-CA 126.327 1.851 . . . . 74.34 114.75 -175.624 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 44.9 mmtm -99.67 -172.17 2.2 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.838 0.855 . . . . 63.31 111.319 179.388 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 -98.71 145.57 30.15 Favored Pre-proline 0 N--CA 1.489 1.512 0 C-N-CA 123.495 0.718 . . . . 73.25 110.52 176.618 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_exo -57.76 -32.73 95.54 Favored 'Trans proline' 0 C--N 1.387 2.558 0 C-N-CA 123.293 2.662 . . . . 54.55 113.839 -178.701 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -61.46 -48.93 78.89 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.998 0.919 . . . . 65.5 111.25 174.357 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -63.3 -41.35 98.95 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.822 0.849 . . . . 75.42 111.396 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.445 HG11 ' HB2' ' A' ' 42' ' ' LEU . 93.9 t -65.49 -42.99 94.51 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 C-N-CA 123.878 0.871 . . . . 35.11 111.441 177.787 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 37.8 t -64.2 -44.14 92.88 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.69 0.796 . . . . 51.33 111.904 -178.851 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.409 ' O ' ' HG3' ' A' ' 59' ' ' GLN . 47.4 mt-10 -65.97 -42.7 89.58 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.229 0.612 . . . . 62.24 111.327 174.431 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.433 ' HE ' ' HB3' ' A' ' 22' ' ' ASP . 32.2 tpt180 -60.86 -41.76 96.53 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.284 0.633 . . . . 72.03 111.414 -179.794 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -53.08 -48.27 67.88 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 124.247 1.019 . . . . 64.35 111.385 173.062 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -75.17 -24.67 57.92 Favored 'General case' 0 CA--C 1.555 1.145 0 CA-C-N 115.168 -0.923 . . . . 72.31 112.315 -178.169 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' A' ' 55' ' ' GLU . 98.0 mt-30 -68.36 -45.03 73.9 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 109.448 -0.575 . . . . 70.43 109.448 171.579 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.612 HD21 ' HB2' ' A' ' 22' ' ' ASP . 31.6 mt -56.01 -56.37 21.58 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.381 1.072 . . . . 72.44 111.75 175.464 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 17.2 mmt . . . . . 0 N--CA 1.481 1.095 0 N-CA-C 112.696 0.628 . . . . 54.14 112.696 -178.102 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 17' ' ' TRP . . . . . 0.441 ' HH2' HG22 ' A' ' 53' ' ' VAL . 90.8 m95 . . . . . 0 CA--C 1.551 0.99 0 N-CA-C 110.545 -0.169 . . . . 75.35 110.545 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 44.5 p -116.89 169.82 9.09 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 123.092 0.557 . . . . 64.21 110.222 176.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 16.7 ptt180 -57.81 -20.84 38.58 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 112.32 0.489 . . . . 72.24 112.32 177.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.434 ' O ' HG23 ' A' ' 24' ' ' VAL . 27.2 m-80 -70.19 -50.63 38.22 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.227 0.611 . . . . 73.21 110.391 175.453 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.459 ' HA ' HD22 ' A' ' 46' ' ' LEU . 16.5 m-20 -65.12 -54.8 24.36 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.239 0.616 . . . . 62.52 111.068 -179.712 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.603 ' HB3' HD21 ' A' ' 60' ' ' LEU . 1.2 m-20 -54.76 -39.38 68.27 Favored 'General case' 0 CA--C 1.559 1.295 0 C-N-CA 124.915 1.286 . . . . 72.4 113.223 -179.384 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 17.5 tpt180 -65.2 -44.81 87.14 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 122.512 0.325 . . . . 74.42 111.484 177.408 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 20' ' ' ASN . 57.7 t -67.69 -31.02 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 C-N-CA 122.787 0.435 . . . . 73.51 112.086 -176.846 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 87.9 mt -55.02 -56.41 11.14 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.417 0 CA-C-O 120.826 0.346 . . . . 51.02 110.432 169.944 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.41 HD11 ' HB3' ' A' ' 60' ' ' LEU . 68.2 mt -65.22 -28.87 69.67 Favored 'General case' 0 CA--C 1.556 1.209 0 C-N-CA 123.314 0.645 . . . . 75.3 112.198 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 61.1 tp -69.11 -48.81 61.55 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.432 0.693 . . . . 63.51 111.518 177.165 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.434 ' HA ' ' HB3' ' A' ' 31' ' ' LYS . 11.2 mm-40 -76.81 -19.19 57.84 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.115 0.566 . . . . 73.43 112.436 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 98.6 m -74.62 -33.25 62.53 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 112.104 0.409 . . . . 63.34 112.104 174.303 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -85.37 -24.04 27.74 Favored 'General case' 0 N--CA 1.493 1.712 0 C-N-CA 122.481 0.313 . . . . 73.13 111.413 172.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.434 ' HB3' ' HA ' ' A' ' 28' ' ' GLU . 60.6 tptt -84.26 -71.57 0.51 Allowed 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.721 0.808 . . . . 75.23 110.953 179.196 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.465 ' HD3' HG23 ' A' ' 38' ' ' THR . 39.9 ttt180 -79.11 -42.52 26.1 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 124.489 1.115 . . . . 73.43 111.824 -176.981 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 125.62 147.66 7.02 Favored Glycine 0 CA--C 1.54 1.6 0 CA-C-O 119.317 -0.713 . . . . 42.3 112.849 179.388 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -73.75 107.48 2.42 Favored 'Trans proline' 0 C--N 1.378 2.085 0 C-N-CA 123.114 2.543 . . . . 75.01 112.118 178.696 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 48.5 t -156.1 151.24 26.5 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.419 0.688 . . . . 54.2 110.814 -178.876 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 64.7 p -64.13 -27.79 69.33 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 122.928 0.491 . . . . 75.43 111.32 175.167 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 40.4 tttm -72.83 -21.66 60.92 Favored 'General case' 0 CA--C 1.561 1.376 0 C-N-CA 123.986 0.914 . . . . 73.14 110.665 175.569 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.465 HG23 ' HD3' ' A' ' 32' ' ' ARG . 81.5 m -86.96 -34.37 19.34 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 124.318 1.047 . . . . 74.44 110.015 173.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.444 ' HD1' HD12 ' A' ' 42' ' ' LEU . 21.5 m-85 -71.38 -28.34 63.97 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.434 0.694 . . . . 75.12 111.836 -179.868 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.482 ' HA ' ' HG3' ' A' ' 50' ' ' PRO . . . -67.98 -32.34 72.69 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.252 0.621 . . . . 63.01 111.44 170.477 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 50.2 t80 -76.05 -38.47 57.1 Favored 'General case' 0 CA--C 1.558 1.279 0 C-N-CA 123.596 0.758 . . . . 63.13 111.291 175.456 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.492 HD23 ' HD2' ' A' ' 45' ' ' LYS . 68.7 mt -66.31 -29.34 69.53 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.969 0.908 . . . . 75.42 111.263 173.335 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.57 -45.07 88.62 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 123.268 0.627 . . . . 63.11 111.203 171.343 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.07 -53.58 56.09 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 123.661 0.784 . . . . 73.22 112.585 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.583 ' HG3' ' HG ' ' A' ' 46' ' ' LEU . 0.2 OUTLIER -71.0 -40.23 71.94 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 112.889 0.7 . . . . 54.15 112.889 -175.844 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.583 ' HG ' ' HG3' ' A' ' 45' ' ' LYS . 81.6 mt -92.87 14.15 18.32 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 112.964 0.727 . . . . 74.43 112.964 -174.56 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.1 p30 51.2 22.45 1.34 Allowed 'General case' 0 N--CA 1.503 2.206 0 C-N-CA 125.951 1.7 . . . . 41.3 114.562 -176.387 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.409 ' HG2' ' O ' ' A' ' 46' ' ' LEU . 47.6 mmtm -101.72 -166.34 1.29 Allowed 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.948 0.899 . . . . 73.42 111.229 -179.587 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -127.45 146.62 59.01 Favored Pre-proline 0 CA--C 1.564 1.481 0 C-N-CA 123.259 0.624 . . . . 75.12 110.248 -179.319 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.482 ' HG3' ' HA ' ' A' ' 40' ' ' ALA . 59.3 Cg_exo -52.45 -38.81 74.85 Favored 'Trans proline' 0 C--N 1.389 2.668 0 C-N-CA 124.037 3.158 . . . . 74.31 115.71 -170.901 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 46.6 t-20 -59.28 -44.83 92.44 Favored 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 123.306 0.643 . . . . 62.04 110.713 177.592 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -67.0 -43.07 83.86 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.938 0.895 . . . . 71.13 110.777 -177.297 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.441 HG22 ' HH2' ' A' ' 17' ' ' TRP . 52.9 t -65.19 -45.81 92.77 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 CA-C-N 115.152 -0.931 . . . . 75.4 111.761 -178.879 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 80.8 p -64.3 -40.4 95.88 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.516 0.727 . . . . 70.12 111.724 -177.358 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -63.6 -49.59 72.74 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 116.043 -0.526 . . . . 62.2 111.176 172.616 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 10.9 tpt85 -60.83 -37.53 82.34 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 115.858 -0.61 . . . . 74.23 111.466 -174.034 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 29.1 t80 -53.13 -53.65 47.37 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 124.529 1.132 . . . . 70.32 112.881 176.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -73.82 -24.58 59.81 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 122.906 0.482 . . . . 62.32 111.968 -175.45 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 82.7 mm-40 -69.97 -42.71 72.78 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.121 0.568 . . . . 64.32 109.795 170.401 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.603 HD21 ' HB3' ' A' ' 22' ' ' ASP . 17.7 mt -61.71 -51.99 66.1 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.736 1.214 . . . . 53.12 112.542 -178.232 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 5.7 mmt . . . . . 0 N--CA 1.485 1.32 0 N-CA-C 112.244 0.461 . . . . 73.44 112.244 179.907 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 86.4 m95 . . . . . 0 N--CA 1.489 1.506 0 N-CA-C 110.547 -0.168 . . . . 74.33 110.547 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 25.1 p -119.98 159.1 25.39 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.93 0.892 . . . . 61.43 110.259 177.224 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 8.7 ptp85 -64.29 -20.75 66.29 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 123.704 0.802 . . . . 64.44 112.205 174.939 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -67.7 -44.88 76.69 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.933 0.893 . . . . 73.54 110.312 173.781 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -59.48 -44.95 92.92 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 123.495 0.718 . . . . 74.11 111.772 177.569 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.41 ' HB3' HD21 ' A' ' 60' ' ' LEU . 61.4 m-20 -54.33 -44.13 71.81 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 124.859 1.264 . . . . 71.42 112.66 179.69 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 61.2 ttp180 -59.62 -43.68 93.7 Favored 'General case' 0 CA--C 1.556 1.184 0 CA-C-N 115.823 -0.626 . . . . 74.34 111.563 177.044 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.6 t -69.28 -38.95 78.45 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 C-N-CA 123.582 0.753 . . . . 73.12 111.534 -177.687 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 90.2 mt -63.72 -52.24 59.78 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 C-N-CA 122.819 0.447 . . . . 53.4 111.012 177.697 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.407 ' HG ' HD13 ' A' ' 60' ' ' LEU . 97.6 mt -58.43 -34.92 71.33 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.129 0.572 . . . . 65.53 111.813 175.437 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 35.2 tp -63.48 -55.28 25.37 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.183 0.593 . . . . 72.14 111.121 178.217 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 54.6 mm-40 -72.43 -23.77 61.12 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 112.874 0.694 . . . . 64.55 112.874 -176.698 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 91.3 m -69.71 -30.01 67.54 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 122.719 0.408 . . . . 53.13 111.238 175.391 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -86.69 -33.31 20.09 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 123.601 0.76 . . . . 75.34 111.8 174.707 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 50.9 mtpt -75.16 -74.9 0.19 Allowed 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 123.493 0.717 . . . . 60.23 111.651 178.524 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 27.2 mtp180 -79.91 -36.93 35.7 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 124.175 0.99 . . . . 63.31 110.353 -172.462 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 122.07 160.4 10.95 Favored Glycine 0 CA--C 1.538 1.497 0 CA-C-N 115.363 -0.835 . . . . 52.44 111.967 -176.425 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -77.64 38.24 0.66 Allowed 'Trans proline' 0 CA--C 1.563 1.937 0 C-N-CA 123.568 2.845 . . . . 53.2 113.593 176.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 34.8 t -75.7 154.24 36.58 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.709 0.804 . . . . 62.44 111.788 179.055 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 98.3 p -61.33 -34.53 75.41 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.847 0.859 . . . . 70.3 111.877 178.092 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt -74.46 -19.51 60.36 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.256 0.622 . . . . 55.32 112.015 177.508 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 51.6 m -78.17 -33.91 49.91 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 109.183 -0.673 . . . . 65.44 109.183 173.426 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -70.64 -30.96 67.72 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.429 0.692 . . . . 72.22 111.245 173.062 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.96 -36.12 77.53 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.339 0.656 . . . . 55.1 111.566 171.163 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 82.4 t80 -63.57 -48.68 76.46 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 123.303 0.641 . . . . 73.35 110.704 171.961 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.453 ' HB2' HG11 ' A' ' 53' ' ' VAL . 59.9 mt -66.77 -23.05 66.03 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 124.603 1.161 . . . . 71.24 112.303 178.218 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.87 -53.52 49.18 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.102 0.561 . . . . 73.33 111.172 171.658 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -71.54 -28.21 63.72 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.09 0.556 . . . . 64.1 112.436 179.406 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.408 ' HE3' ' HA ' ' A' ' 45' ' ' LYS . 0.2 OUTLIER -72.8 -47.32 47.52 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.508 0.723 . . . . 72.33 111.247 178.686 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 52.1 mt -101.22 5.22 42.48 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.449 0.7 . . . . 71.24 112.444 -172.14 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 61.65 29.67 18.25 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 124.304 1.042 . . . . 42.31 112.217 -177.008 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.0 mmtm -104.0 -165.81 1.19 Allowed 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 124.565 1.146 . . . . 73.41 110.434 178.874 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 65.0 m-20 -119.96 145.59 40.09 Favored Pre-proline 0 N--CA 1.489 1.49 0 CA-C-O 118.36 -0.829 . . . . 71.34 110.43 178.104 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -50.78 -46.03 32.44 Favored 'Trans proline' 0 C--N 1.385 2.487 0 C-N-CA 123.638 2.892 . . . . 75.02 114.801 -174.395 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -66.31 -41.59 89.47 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.643 0.777 . . . . 55.25 111.13 179.143 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.22 -34.7 78.03 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.725 0.81 . . . . 72.55 111.995 -178.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.453 HG11 ' HB2' ' A' ' 42' ' ' LEU . 60.6 t -71.77 -38.9 67.52 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 C-N-CA 123.016 0.526 . . . . 74.53 110.583 174.041 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.2 t -59.91 -44.46 94.26 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.954 0.901 . . . . 35.31 111.093 177.853 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -63.65 -43.9 95.39 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.06 0.544 . . . . 64.4 110.986 173.709 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 23.5 tpt180 -63.68 -35.22 79.82 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.629 0.772 . . . . 55.1 112.666 -176.195 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -54.71 -47.47 73.69 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.601 0.761 . . . . 74.0 110.873 171.197 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -73.95 -24.29 59.62 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 115.191 -0.913 . . . . 74.45 112.04 -178.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -70.19 -38.04 75.24 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.111 0.564 . . . . 73.31 110.173 172.166 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.41 HD21 ' HB3' ' A' ' 22' ' ' ASP . 31.7 mt -60.87 -53.55 56.0 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.179 0.992 . . . . 72.35 111.577 175.03 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 90.1 mmm . . . . . 0 N--CA 1.484 1.237 0 C-N-CA 122.954 0.502 . . . . 63.33 111.651 178.422 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 17' ' ' TRP . . . . . 0.464 ' CH2' ' HG3' ' A' ' 48' ' ' LYS . 96.8 m95 . . . . . 0 N--CA 1.481 1.075 0 N-CA-C 110.238 -0.282 . . . . 73.11 110.238 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 82.1 p -128.75 170.22 13.57 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 123.345 0.658 . . . . 62.41 111.304 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 39.5 ptt180 -52.76 -29.71 28.75 Favored 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 124.807 1.243 . . . . 72.54 113.576 -175.054 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.442 ' O ' HG23 ' A' ' 24' ' ' VAL . 18.3 m120 -77.87 -44.46 27.09 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 123.284 0.634 . . . . 75.31 111.714 177.677 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -59.5 -49.78 76.46 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 122.983 0.513 . . . . 54.12 111.582 -178.398 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.682 ' HB2' HD21 ' A' ' 60' ' ' LEU . 2.9 p30 -68.72 -32.45 72.26 Favored 'General case' 0 CA--C 1.558 1.282 0 CA-C-N 115.519 -0.764 . . . . 71.31 112.243 -177.769 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -63.85 -37.41 87.28 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 123.302 0.641 . . . . 75.44 111.296 173.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 20' ' ' ASN . 86.4 t -69.0 -38.03 77.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 C-N-CA 123.242 0.617 . . . . 73.13 111.298 176.338 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.404 HD11 ' CZ3' ' A' ' 17' ' ' TRP . 81.9 mt -55.96 -57.49 8.15 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 C-N-CA 122.439 0.295 . . . . 73.22 110.243 173.657 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.515 ' HG ' HD13 ' A' ' 60' ' ' LEU . 96.0 mt -60.12 -36.52 77.66 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.638 0.775 . . . . 72.32 112.517 178.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 42.5 tp -59.61 -59.07 6.03 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.138 0.575 . . . . 72.22 110.701 -179.006 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -70.69 -25.54 63.02 Favored 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 123.338 0.655 . . . . 71.33 112.536 -179.552 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 90.4 m -73.66 -36.79 65.41 Favored 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 112.353 0.501 . . . . 61.42 112.353 178.767 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -81.5 -30.71 33.19 Favored 'General case' 0 N--CA 1.492 1.627 0 CA-C-O 121.378 0.609 . . . . 71.22 111.03 176.112 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -72.17 -46.66 55.44 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 125.147 1.379 . . . . 70.44 112.522 178.842 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 53.3 mtp180 -114.78 -25.08 8.39 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 123.91 0.884 . . . . 55.14 112.722 -170.353 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 108.65 129.13 5.87 Favored Glycine 0 N--CA 1.479 1.52 0 CA-C-O 118.915 -0.936 . . . . 41.35 111.879 -173.902 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -74.2 85.43 1.4 Allowed 'Trans proline' 0 C--N 1.377 2.053 0 C-N-CA 122.618 2.212 . . . . 64.32 112.684 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 18.0 t -141.19 -179.24 5.99 Favored 'General case' 0 N--CA 1.482 1.159 0 CA-C-N 115.42 -0.809 . . . . 75.45 110.496 178.606 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 84.0 p -58.8 -36.44 74.45 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 114.156 1.169 . . . . 74.14 114.156 -169.13 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -70.0 -27.49 64.74 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 123.004 0.522 . . . . 73.0 111.866 -178.47 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 70.4 m -85.66 -43.76 13.16 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.437 0.695 . . . . 63.05 109.987 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -67.84 -29.29 68.39 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.363 0.665 . . . . 75.11 112.051 178.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.19 -39.92 90.03 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 122.918 0.487 . . . . 75.5 111.211 173.211 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 66.8 t80 -65.41 -51.09 62.75 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 116.077 -0.511 . . . . 72.2 110.686 174.889 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 79.4 mt -59.64 -31.02 69.14 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 124.362 1.065 . . . . 75.35 112.56 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.71 -56.04 14.18 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.344 0.657 . . . . 72.15 111.022 172.678 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.82 -25.8 68.07 Favored 'General case' 0 CA--C 1.56 1.363 0 C-N-CA 123.655 0.782 . . . . 50.01 112.617 178.254 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -76.89 -52.11 10.04 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 124.124 0.97 . . . . 74.22 111.34 -177.155 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.413 ' HB2' ' HG2' ' A' ' 48' ' ' LYS . 51.4 mt -91.19 -2.42 57.51 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 124.082 0.953 . . . . 61.15 111.904 -176.141 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.5 t70 69.25 33.5 3.25 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 125.312 1.445 . . . . 71.41 111.425 -177.821 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.464 ' HG3' ' CH2' ' A' ' 17' ' ' TRP . 67.9 mmtt -105.33 -167.18 1.3 Allowed 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 124.489 1.116 . . . . 74.33 110.749 177.289 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -118.71 149.04 45.63 Favored Pre-proline 0 N--CA 1.489 1.523 0 C-N-CA 123.751 0.82 . . . . 72.4 109.996 171.638 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -51.36 -42.1 56.27 Favored 'Trans proline' 0 C--N 1.387 2.556 0 C-N-CA 123.689 2.926 . . . . 73.22 115.761 -172.136 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -65.27 -39.73 93.0 Favored 'General case' 0 N--CA 1.494 1.733 0 C-N-CA 122.621 0.368 . . . . 74.31 111.437 177.402 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.443 ' O ' ' HD3' ' A' ' 56' ' ' ARG . 79.7 mt-30 -65.79 -31.18 72.01 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.552 0.741 . . . . 72.04 111.234 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 95.7 t -74.89 -46.95 39.28 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.145 0 C-N-CA 123.517 0.727 . . . . 72.12 111.016 175.168 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 35.0 t -64.73 -36.13 83.3 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 124.103 0.961 . . . . 74.35 112.801 -174.438 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -71.94 -39.31 69.5 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 122.671 0.388 . . . . 70.42 111.874 177.509 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.443 ' HD3' ' O ' ' A' ' 52' ' ' GLN . 5.7 mpt_? -69.53 -29.39 66.98 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 122.647 0.379 . . . . 64.04 111.026 176.81 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.48 ' HA ' HD12 ' A' ' 60' ' ' LEU . 8.2 t80 -55.37 -43.8 75.46 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.705 0.802 . . . . 75.44 111.019 168.661 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -74.75 -25.13 58.88 Favored 'General case' 0 CA--C 1.558 1.257 0 C-N-CA 123.47 0.708 . . . . 71.41 112.38 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -74.36 -31.85 62.55 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.346 0.593 . . . . 64.05 110.244 171.396 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.682 HD21 ' HB2' ' A' ' 22' ' ' ASP . 38.6 mt -65.83 -34.82 79.03 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.189 0.996 . . . . 72.24 111.482 172.621 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 33.8 mmt . . . . . 0 N--CA 1.482 1.15 0 C-N-CA 123.008 0.523 . . . . 74.11 111.564 175.204 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 82.4 m95 . . . . . 0 N--CA 1.477 0.889 0 CA-C-O 120.607 0.242 . . . . 75.44 110.802 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 30.1 p -97.03 155.95 16.57 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 108.324 -0.991 . . . . 65.02 108.324 171.458 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 35.3 ptt180 -58.93 -20.31 50.82 Favored 'General case' 0 CA--C 1.558 1.253 0 N-CA-C 112.237 0.458 . . . . 74.12 112.237 176.116 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -71.19 -40.49 71.19 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.969 0.908 . . . . 62.34 111.472 175.024 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.436 ' HA ' HD22 ' A' ' 46' ' ' LEU . 28.9 m-20 -60.54 -61.65 2.43 Favored 'General case' 0 N--CA 1.487 1.378 0 CA-C-O 121.49 0.662 . . . . 75.14 111.281 176.916 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.576 ' HB2' HD11 ' A' ' 60' ' ' LEU . 1.7 p30 -64.91 -28.67 69.69 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 113.624 0.972 . . . . 63.41 113.624 -174.231 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 28.2 tpt85 -56.21 -38.67 71.34 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 123.03 0.532 . . . . 73.15 111.921 173.238 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 44.0 t -72.9 -31.54 36.4 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 123.332 0.653 . . . . 73.35 111.184 177.059 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 66.0 mt -59.86 -47.19 92.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 C-N-CA 122.527 0.331 . . . . 65.11 110.34 172.743 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.411 HD21 ' HB3' ' A' ' 60' ' ' LEU . 97.4 mt -56.26 -38.96 71.86 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.741 0.817 . . . . 71.14 112.002 175.181 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 57.8 tp -63.81 -59.17 4.88 Favored 'General case' 0 CA--C 1.556 1.175 0 C-N-CA 123.419 0.688 . . . . 72.52 111.739 179.418 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -69.95 -22.15 63.2 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 113.236 0.828 . . . . 63.22 113.236 -175.659 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 65.7 m -69.8 -30.09 67.54 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 122.458 0.303 . . . . 43.33 111.415 173.231 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -84.19 -39.17 19.69 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 122.965 0.506 . . . . 75.32 111.026 174.681 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -61.44 -64.36 0.97 Allowed 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.975 0.91 . . . . 75.54 111.789 178.533 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.49 ' HD2' HG23 ' A' ' 38' ' ' THR . 37.5 mtt-85 -91.07 -52.19 4.96 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.74 0.816 . . . . 70.55 110.976 -174.368 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 131.08 147.1 5.97 Favored Glycine 0 CA--C 1.534 1.249 0 CA-C-N 115.157 -0.929 . . . . 34.11 111.391 -173.013 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -61.06 95.61 0.12 Allowed 'Trans proline' 0 C--N 1.374 1.869 0 C-N-CA 122.894 2.396 . . . . 73.42 112.445 175.524 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 48.3 t -146.95 157.06 43.52 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.985 0.914 . . . . 72.14 110.531 -175.588 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 81.0 p -65.34 -31.94 73.33 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.457 0.703 . . . . 73.53 112.407 -177.753 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -69.95 -26.66 64.22 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 123.286 0.634 . . . . 72.34 111.726 174.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.49 HG23 ' HD2' ' A' ' 32' ' ' ARG . 97.3 m -77.97 -42.99 31.01 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.759 0.823 . . . . 72.1 109.152 177.161 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -63.86 -28.81 70.1 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 124.028 0.931 . . . . 73.04 111.318 173.285 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.556 ' HA ' ' HG3' ' A' ' 50' ' ' PRO . . . -69.24 -42.35 75.75 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.372 0.669 . . . . 45.14 111.522 175.705 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -59.71 -49.41 77.84 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-O 121.077 0.465 . . . . 70.13 110.51 171.658 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 64.9 mt -63.74 -23.97 67.58 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.537 1.135 . . . . 74.23 112.741 178.495 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.77 -53.95 33.66 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.127 0.571 . . . . 73.12 110.727 172.596 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.27 -35.29 80.58 Favored 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 123.308 0.643 . . . . 25.4 111.635 177.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 58.2 tptt -66.93 -49.7 64.71 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.542 1.137 . . . . 75.42 111.693 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.436 HD22 ' HA ' ' A' ' 21' ' ' ASP . 64.9 mt -96.1 -2.15 47.14 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 113.013 0.746 . . . . 45.43 113.013 -172.715 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 79.88 -1.21 2.1 Favored 'General case' 0 N--CA 1.505 2.312 0 C-N-CA 126.117 1.767 . . . . 74.42 113.398 -178.813 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -88.88 -168.02 2.06 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 112.31 0.485 . . . . 64.01 112.31 -179.532 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -108.43 152.73 42.17 Favored Pre-proline 0 N--CA 1.484 1.248 0 C-N-CA 124.229 1.012 . . . . 75.04 110.126 173.25 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.556 ' HG3' ' HA ' ' A' ' 40' ' ' ALA . 37.4 Cg_exo -57.17 -34.17 97.26 Favored 'Trans proline' 0 C--N 1.39 2.72 0 C-N-CA 123.439 2.759 . . . . 74.21 114.203 -172.37 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.423 ' O ' ' HG3' ' A' ' 55' ' ' GLU . 18.3 m120 -67.78 -39.75 84.06 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.372 0.669 . . . . 65.24 111.497 177.779 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -66.33 -42.22 88.49 Favored 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 123.225 0.61 . . . . 73.24 110.453 177.88 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 82.0 t -57.58 -41.15 78.47 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 124.314 1.046 . . . . 65.05 111.049 173.754 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.499 ' O ' ' HG3' ' A' ' 58' ' ' GLN . 34.3 t -65.59 -41.25 93.05 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.152 0.581 . . . . 70.12 111.503 178.422 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.423 ' HG3' ' O ' ' A' ' 51' ' ' ASN . 52.0 mt-10 -57.98 -49.55 76.44 Favored 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 123.049 0.54 . . . . 60.42 111.142 176.764 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.4 tpm_? -62.16 -39.1 91.5 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 124.169 0.988 . . . . 71.51 111.818 176.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.415 ' HA ' HD12 ' A' ' 60' ' ' LEU . 16.0 t80 -56.14 -49.77 73.01 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 124.59 1.156 . . . . 71.02 112.252 177.288 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.499 ' HG3' ' O ' ' A' ' 54' ' ' SER . 62.3 mt-30 -68.59 -25.83 65.07 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.479 0.711 . . . . 73.11 111.439 -176.391 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 71.2 mt-30 -71.31 -47.73 54.96 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 115.427 -0.806 . . . . 71.24 109.668 171.791 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.576 HD11 ' HB2' ' A' ' 22' ' ' ASP . 58.2 mt -52.93 -46.65 68.2 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 124.497 1.119 . . . . 55.21 112.603 178.34 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 33.9 mmt . . . . . 0 N--CA 1.482 1.14 0 C-N-CA 123.102 0.561 . . . . 75.03 111.822 -179.155 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 95.4 m95 . . . . . 0 N--CA 1.484 1.273 0 N-CA-C 110.025 -0.361 . . . . 65.04 110.025 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 27.1 p -106.03 166.88 10.18 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.2 0.6 . . . . 65.35 109.845 179.236 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.47 -20.77 66.39 Favored 'General case' 0 CA--C 1.552 1.048 0 CA-C-N 115.923 -0.58 . . . . 74.12 112.461 175.784 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -73.13 -43.33 61.78 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.651 0.78 . . . . 63.41 110.66 173.689 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -57.84 -44.95 86.82 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.893 0.477 . . . . 74.13 110.848 171.967 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 -56.64 -53.13 61.19 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 124.111 0.964 . . . . 73.21 111.511 176.51 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 19.8 tpp180 -55.64 -47.76 76.11 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.911 0.884 . . . . 74.15 111.636 179.577 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 82.2 t -66.64 -43.7 90.2 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.152 0 C-N-CA 122.936 0.494 . . . . 72.42 112.137 -177.438 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 73.4 mt -56.79 -53.01 47.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 CA-C-N 118.324 0.511 . . . . 74.44 111.18 175.814 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.418 HD11 HD22 ' A' ' 60' ' ' LEU . 73.3 mt -61.25 -37.49 83.28 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 123.789 0.836 . . . . 74.41 112.231 -179.53 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 36.2 tp -73.78 -58.15 3.5 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.336 0.654 . . . . 62.23 111.734 -176.439 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.601 ' HB2' HD21 ' A' ' 42' ' ' LEU . 4.2 mm-40 -66.89 -23.51 66.01 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.141 0.576 . . . . 74.13 112.1 -175.286 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 99.2 m -70.77 -29.92 66.26 Favored 'General case' 0 N--CA 1.493 1.715 0 C-N-CA 122.932 0.493 . . . . 73.23 111.742 172.885 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -77.58 -25.89 50.34 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.874 -0.517 . . . . 74.34 111.438 172.573 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.1 mpmm? -76.17 -62.74 1.51 Allowed 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.59 0.756 . . . . 72.25 111.633 178.807 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 7.4 mpt_? -93.13 -2.73 55.09 Favored 'General case' 0 N--CA 1.49 1.525 0 N-CA-C 112.826 0.676 . . . . 73.2 112.826 -174.669 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.73 146.22 18.6 Favored Glycine 0 N--CA 1.487 2.041 0 CA-C-O 119.095 -0.836 . . . . 65.3 112.602 -173.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -77.49 43.05 1.25 Allowed 'Trans proline' 0 C--N 1.376 1.991 0 C-N-CA 123.373 2.715 . . . . 64.52 113.543 -177.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 42.6 m -97.35 168.68 10.26 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.18 0.992 . . . . 61.43 111.543 -177.084 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.429 ' HA ' ' HD2' ' A' ' 39' ' ' PHE . 89.9 p -61.1 -30.87 70.62 Favored 'General case' 0 N--CA 1.499 1.99 0 C-N-CA 123.35 0.66 . . . . 75.2 112.26 179.282 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 62.3 tttm -58.45 -28.24 65.11 Favored 'General case' 0 CA--C 1.559 1.318 0 C-N-CA 124.392 1.077 . . . . 71.31 112.165 175.252 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 59.4 m -93.26 -34.23 13.64 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.524 0.73 . . . . 73.33 110.959 -178.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' PHE . . . . . 0.429 ' HD2' ' HA ' ' A' ' 36' ' ' SER . 33.8 m-85 -62.54 -33.69 75.43 Favored 'General case' 0 N--CA 1.489 1.518 0 CA-C-O 121.153 0.501 . . . . 74.52 111.418 174.271 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.16 -41.36 94.78 Favored 'General case' 0 CA--C 1.557 1.234 0 C-N-CA 123.693 0.797 . . . . 73.22 111.493 173.22 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 77.0 t80 -62.34 -52.33 64.09 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.825 0.85 . . . . 64.13 111.209 174.729 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.601 HD21 ' HB2' ' A' ' 28' ' ' GLU . 80.7 mt -60.24 -31.37 70.13 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 125.094 1.357 . . . . 75.33 113.031 -178.764 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.37 -53.37 58.4 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.326 0.65 . . . . 70.55 111.639 175.631 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.56 -27.76 62.41 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 122.859 0.463 . . . . 22.23 111.968 177.031 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -72.66 -30.51 64.34 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 124.153 0.981 . . . . 74.21 111.787 -178.157 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 97.0 mt -116.33 4.66 13.46 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.618 0.767 . . . . 52.22 112.427 -177.36 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 61.34 27.53 17.16 Favored 'General case' 0 N--CA 1.497 1.9 0 C-N-CA 124.231 1.013 . . . . 72.45 112.594 -176.699 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -102.54 -174.67 2.62 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.369 1.067 . . . . 72.44 111.132 179.429 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -107.71 140.66 21.79 Favored Pre-proline 0 N--CA 1.486 1.353 0 C-N-CA 123.656 0.782 . . . . 74.2 109.402 175.692 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -56.43 -34.58 94.91 Favored 'Trans proline' 0 C--N 1.387 2.569 0 C-N-CA 123.105 2.536 . . . . 54.23 113.644 -172.87 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -60.35 -48.05 83.42 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.183 0.993 . . . . 73.52 111.024 175.12 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 9.0 mm100 -72.97 -30.24 63.67 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.687 0.795 . . . . 64.42 111.681 -177.041 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 71.4 t -65.52 -44.03 94.14 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 123.292 0.637 . . . . 75.04 110.55 173.864 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 44.1 t -64.57 -42.97 95.29 Favored 'General case' 0 N--CA 1.485 1.302 0 CA-C-N 115.952 -0.567 . . . . 75.44 111.265 177.123 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -60.73 -44.47 96.6 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 123.576 0.751 . . . . 72.43 111.944 175.096 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 16.3 tpt180 -68.57 -39.15 81.12 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 122.642 0.377 . . . . 72.3 111.201 179.729 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -58.44 -53.03 62.97 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 124.063 0.945 . . . . 73.35 111.631 179.111 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 66.6 mt-30 -73.04 -26.7 61.39 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-N 115.324 -0.853 . . . . 71.11 111.226 -176.243 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 12.3 tm0? -69.7 -41.59 75.18 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 123.6 0.76 . . . . 72.21 109.366 173.822 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.418 HD22 HD11 ' A' ' 26' ' ' LEU . 13.0 mt -56.15 -48.13 76.87 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 124.355 1.062 . . . . 73.53 110.895 172.556 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 29.2 mmt . . . . . 0 N--CA 1.485 1.291 0 C-N-CA 123.235 0.614 . . . . 72.15 111.22 176.382 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 17' ' ' TRP . . . . . 0.686 ' HZ2' ' HB3' ' A' ' 52' ' ' GLN . 81.6 m95 . . . . . 0 N--CA 1.477 0.924 0 N-CA-C 109.89 -0.411 . . . . 74.41 109.89 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 43.9 p -96.67 161.52 13.84 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 122.814 0.446 . . . . 51.13 110.834 -178.177 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 35.0 ptt180 -57.65 -23.26 50.33 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.527 0.731 . . . . 74.45 111.904 171.955 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -69.69 -46.24 66.47 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 123.905 0.882 . . . . 75.44 110.73 175.524 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.4 m-20 -58.61 -47.09 85.52 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.017 0.527 . . . . 53.13 111.234 174.198 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.448 ' HB3' HD21 ' A' ' 60' ' ' LEU . 56.5 m-20 -55.94 -47.16 78.07 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.157 0.983 . . . . 75.25 112.254 176.844 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 32.3 ttm180 -61.57 -40.22 93.98 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.915 0.486 . . . . 72.51 112.016 179.737 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 85.4 t -69.27 -40.0 79.75 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 122.73 0.412 . . . . 72.45 111.643 178.649 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 81.3 mt -58.88 -43.58 88.75 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 CA-C-O 120.877 0.37 . . . . 54.23 110.991 175.92 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 88.5 mt -70.94 -35.04 72.04 Favored 'General case' 0 CA--C 1.555 1.149 0 C-N-CA 123.287 0.635 . . . . 73.53 111.694 176.139 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 31.0 tp -67.27 -52.0 46.11 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.862 0.865 . . . . 71.34 111.719 -176.293 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -74.42 -20.49 60.03 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.123 0.569 . . . . 65.15 111.684 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 53.4 t -72.08 -34.7 68.89 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 122.85 0.46 . . . . 72.23 111.174 171.2 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -79.74 -15.61 57.18 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.158 0.583 . . . . 72.53 111.423 172.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 56.2 tptt -80.78 -48.38 12.56 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 123.694 0.798 . . . . 64.32 110.94 175.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 50.6 mtt180 -106.46 -63.58 1.26 Allowed 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.737 0.815 . . . . 75.43 111.447 -178.537 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 136.7 154.1 6.66 Favored Glycine 0 CA--C 1.539 1.544 0 CA-C-O 119.086 -0.841 . . . . 71.12 111.694 -172.196 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_exo -57.68 109.08 0.43 Allowed 'Trans proline' 0 C--N 1.374 1.88 0 C-N-CA 123.128 2.552 . . . . 44.31 113.168 176.319 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 46.7 t -156.39 155.37 32.03 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.316 0.646 . . . . 71.43 111.371 -177.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 58.4 p -62.91 -33.47 75.4 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.547 0.739 . . . . 73.31 111.23 172.286 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -63.96 -33.85 76.65 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.516 0.726 . . . . 73.35 111.124 173.424 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 38.4 m -83.36 -27.98 29.29 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 123.276 0.63 . . . . 55.42 110.192 -176.819 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 22.5 m-30 -69.35 -36.29 76.73 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.242 0.617 . . . . 63.34 110.849 172.483 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.02 -39.84 87.12 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 123.451 0.7 . . . . 73.2 110.924 173.728 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -65.54 -39.52 91.84 Favored 'General case' 0 CA--C 1.557 1.242 0 C-N-CA 124.425 1.09 . . . . 73.12 111.876 176.304 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.465 ' HB2' HG11 ' A' ' 53' ' ' VAL . 39.5 mt -73.41 -29.28 62.49 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 124.168 0.987 . . . . 72.14 112.248 175.767 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.47 -39.18 93.77 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 122.867 0.467 . . . . 55.25 110.385 171.514 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -71.36 -43.27 67.24 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 123.52 0.728 . . . . 43.33 112.001 175.281 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -70.05 -39.91 75.41 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.937 0.895 . . . . 71.14 112.09 -172.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 91.9 mt -100.26 -3.48 31.33 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.601 0.761 . . . . 75.43 112.962 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 60.15 25.01 14.32 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 124.246 1.018 . . . . 72.44 112.311 -177.192 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 48.6 mmtm -94.43 171.9 8.53 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 124.197 0.999 . . . . 71.15 110.291 177.324 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 37.4 m-80 -75.62 145.05 78.17 Favored Pre-proline 0 N--CA 1.486 1.333 0 CA-C-O 118.944 -0.55 . . . . 64.31 110.127 174.359 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -60.42 -28.83 87.49 Favored 'Trans proline' 0 C--N 1.381 2.252 0 C-N-CA 122.443 2.096 . . . . 73.32 112.503 178.146 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -72.27 -39.53 68.3 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.283 1.033 . . . . 71.35 110.629 177.413 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.686 ' HB3' ' HZ2' ' A' ' 17' ' ' TRP . 24.3 mm-40 -63.73 -38.27 90.49 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.603 0.761 . . . . 73.15 111.906 173.419 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.465 HG11 ' HB2' ' A' ' 42' ' ' LEU . 69.6 t -69.64 -48.88 63.0 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 C-N-CA 123.268 0.627 . . . . 73.11 111.877 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 79.9 p -58.04 -42.72 86.0 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 123.117 0.567 . . . . 71.32 111.48 179.001 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -61.83 -52.58 63.58 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.989 0.516 . . . . 71.11 112.203 173.774 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 28.4 tpt180 -65.25 -31.3 72.39 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 122.896 0.479 . . . . 73.43 112.108 -174.576 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -57.27 -52.28 65.95 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.869 0.868 . . . . 73.02 110.847 171.839 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -73.77 -23.36 59.71 Favored 'General case' 0 CA--C 1.552 1.035 0 CA-C-N 115.472 -0.786 . . . . 64.04 112.219 -176.516 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 36.1 mm-40 -65.86 -46.94 76.6 Favored 'General case' 0 N--CA 1.484 1.259 0 N-CA-C 109.469 -0.567 . . . . 43.44 109.469 168.779 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.448 HD21 ' HB3' ' A' ' 22' ' ' ASP . 21.6 mt -58.62 -45.22 89.68 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.298 1.039 . . . . 70.5 112.304 175.77 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 36.0 mmt . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 121.261 0.553 . . . . 74.21 111.295 177.411 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 89.6 m95 . . . . . 0 N--CA 1.491 1.586 0 N-CA-C 110.061 -0.348 . . . . 71.33 110.061 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 15.8 p -101.59 165.78 11.05 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 109.902 -0.407 . . . . 71.54 109.902 173.068 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 20.2 ptp180 -66.55 -21.37 66.15 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.211 0.604 . . . . 75.22 111.281 177.153 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.415 ' O ' HG23 ' A' ' 24' ' ' VAL . 5.8 m120 -75.58 -50.67 14.87 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.167 0.987 . . . . 63.54 110.097 179.81 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 52.7 m-20 -63.59 -42.31 98.28 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.132 0.573 . . . . 74.04 110.606 177.153 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -53.87 -50.42 66.31 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 125.034 1.334 . . . . 63.01 111.281 176.115 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.6 -29.14 65.47 Favored 'General case' 0 CA--C 1.558 1.257 0 CA-C-N 115.305 -0.861 . . . . 65.32 112.014 -178.724 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 20' ' ' ASN . 53.7 t -68.93 -40.88 81.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 C-N-CA 122.717 0.407 . . . . 54.42 110.952 173.831 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 86.8 mt -56.99 -59.42 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.364 0 O-C-N 123.306 0.378 . . . . 73.02 110.288 175.832 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.545 HD11 HD22 ' A' ' 60' ' ' LEU . 83.9 mt -59.8 -34.1 72.59 Favored 'General case' 0 N--CA 1.485 1.302 0 N-CA-C 112.833 0.679 . . . . 61.23 112.833 -176.486 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 37.6 tp -75.93 -57.0 4.13 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.135 0.574 . . . . 74.1 112.255 -175.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.749 ' HB2' HD21 ' A' ' 42' ' ' LEU . 24.5 mt-10 -77.75 -18.81 56.1 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 112.893 0.701 . . . . 74.22 112.893 -176.49 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.479 ' SG ' ' HA ' ' A' ' 34' ' ' PRO . 43.1 t -70.9 -51.01 28.8 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.635 0.374 . . . . 63.11 110.922 176.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -66.87 -27.91 67.91 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 122.863 0.465 . . . . 71.52 111.61 174.622 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 59.9 tptt -65.05 -50.08 67.61 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.814 0.845 . . . . 53.23 111.057 176.75 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 61.3 mtp85 -100.6 11.67 39.0 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 112.766 0.654 . . . . 71.13 112.766 -175.983 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 79.51 110.8 0.24 Allowed Glycine 0 CA--C 1.544 1.892 0 CA-C-O 118.762 -1.021 . . . . 61.23 112.377 178.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.479 ' HA ' ' SG ' ' A' ' 29' ' ' CYS . 20.1 Cg_endo -57.53 99.34 0.09 OUTLIER 'Trans proline' 0 C--N 1.382 2.32 0 C-N-CA 123.373 2.716 . . . . 52.24 113.691 -173.983 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 23.0 t -157.37 174.22 15.74 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.224 0.609 . . . . 74.23 112.004 -172.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 60.5 p -55.5 -50.33 70.22 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 124.78 1.232 . . . . 73.14 113.689 -175.47 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 26.5 mtpp -69.22 -15.13 63.31 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 112.9 0.704 . . . . 54.33 112.9 -178.82 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.404 HG21 ' HA ' ' A' ' 29' ' ' CYS . 27.5 m -87.31 -34.06 19.0 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.469 0.708 . . . . 60.34 109.693 177.124 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -66.67 -35.67 80.7 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.212 0.605 . . . . 73.2 110.847 173.203 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.41 -36.55 83.11 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.455 0.702 . . . . 55.52 111.775 175.226 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -63.24 -55.66 23.05 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.376 0.67 . . . . 71.23 111.216 172.908 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.749 HD21 ' HB2' ' A' ' 28' ' ' GLU . 81.2 mt -62.17 -23.25 66.48 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 124.177 0.991 . . . . 75.05 112.616 178.906 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.3 -57.7 8.63 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.347 0.659 . . . . 70.43 111.32 173.617 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.9 -30.67 71.3 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-N 115.876 -0.602 . . . . 62.11 111.666 178.777 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.405 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 0.5 OUTLIER -68.28 -42.87 78.89 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 123.703 0.801 . . . . 75.24 111.78 177.801 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 89.8 mt -104.25 12.85 33.2 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 123.485 0.714 . . . . 74.22 112.831 -175.448 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.2 t70 64.18 16.09 9.8 Favored 'General case' 0 CA--C 1.575 1.911 0 C-N-CA 124.064 0.946 . . . . 74.32 112.558 175.549 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -107.83 -175.11 2.69 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.777 0.831 . . . . 74.45 112.008 -178.431 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -91.65 150.98 41.93 Favored Pre-proline 0 N--CA 1.484 1.236 0 C-N-CA 123.302 0.641 . . . . 73.21 110.145 176.608 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 79.1 Cg_exo -52.59 -35.41 67.18 Favored 'Trans proline' 0 C--N 1.384 2.402 0 C-N-CA 122.857 2.371 . . . . 54.35 113.618 174.781 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -64.46 -46.9 81.13 Favored 'General case' 0 CA--C 1.557 1.248 0 C-N-CA 123.172 0.589 . . . . 73.31 110.43 176.379 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -54.78 -46.84 74.47 Favored 'General case' 0 N--CA 1.499 1.977 0 C-N-CA 123.743 0.817 . . . . 73.22 112.008 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.536 HG11 ' HB2' ' A' ' 42' ' ' LEU . 69.4 t -65.7 -45.41 92.06 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 CA-C-N 115.286 -0.87 . . . . 65.32 111.183 179.728 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' SER . . . . . 0.445 ' O ' ' HG3' ' A' ' 58' ' ' GLN . 35.0 t -58.09 -43.39 87.06 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.344 0.658 . . . . 71.31 111.6 177.286 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -62.09 -53.91 48.71 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.511 0.725 . . . . 72.14 111.64 178.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.409 ' HA ' ' HD2' ' A' ' 56' ' ' ARG . 10.7 tpt180 -61.59 -38.49 87.76 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 122.683 0.393 . . . . 75.42 111.621 -178.704 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -55.46 -52.62 63.02 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.853 0.861 . . . . 74.43 112.134 174.993 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.445 ' HG3' ' O ' ' A' ' 54' ' ' SER . 83.3 mt-30 -73.59 -24.39 60.06 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.326 0.65 . . . . 75.5 112.136 -175.493 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -68.3 -43.61 77.29 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 122.998 0.519 . . . . 63.23 109.641 170.113 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.545 HD22 HD11 ' A' ' 26' ' ' LEU . 14.3 mt -60.59 -45.55 93.53 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.285 1.034 . . . . 51.23 112.262 176.057 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 35.1 mmt . . . . . 0 N--CA 1.488 1.449 0 C-N-CA 123.364 0.666 . . . . 64.41 110.768 175.024 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 17' ' ' TRP . . . . . 0.583 ' HZ3' HD13 ' A' ' 46' ' ' LEU . 98.6 m95 . . . . . 0 N--CA 1.485 1.312 0 N-CA-C 110.414 -0.217 . . . . 75.33 110.414 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 18.0 p -122.2 158.16 30.02 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 109.259 -0.645 . . . . 71.12 109.259 170.278 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.6 ptp180 -63.24 -19.04 64.19 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 123.562 0.745 . . . . 72.02 112.673 176.541 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.471 ' O ' HG23 ' A' ' 24' ' ' VAL . 25.5 m-80 -68.55 -46.71 68.75 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.124 0.57 . . . . 74.24 109.755 170.964 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -62.92 -43.57 98.42 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 123.589 0.756 . . . . 74.5 111.24 176.262 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.674 ' HB3' HD21 ' A' ' 60' ' ' LEU . 68.7 m-20 -56.51 -42.68 78.8 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.742 1.217 . . . . 64.22 111.768 175.69 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 32.5 ttm180 -61.37 -45.68 93.35 Favored 'General case' 0 N--CA 1.483 1.186 0 CA-C-N 115.48 -0.782 . . . . 63.21 110.917 175.467 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.471 HG23 ' O ' ' A' ' 20' ' ' ASN . 78.2 t -62.34 -41.69 92.6 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 C-N-CA 123.988 0.915 . . . . 72.43 112.207 -177.835 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 88.6 mt -61.2 -52.86 56.5 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 C-N-CA 122.327 0.251 . . . . 72.42 110.803 177.429 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.491 ' HG ' HD13 ' A' ' 60' ' ' LEU . 94.1 mt -58.65 -37.08 75.19 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.489 0.716 . . . . 74.33 112.18 176.829 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 28.3 tp -74.82 -50.55 16.78 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.61 0.764 . . . . 61.32 111.706 -174.351 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -74.64 -18.74 60.5 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 123.171 0.588 . . . . 54.11 112.162 -177.519 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 87.2 m -66.17 -30.14 70.56 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 122.628 0.371 . . . . 52.55 111.092 166.366 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLN . . . . . 0.402 ' HG2' ' O ' ' A' ' 26' ' ' LEU . 12.6 mm100 -81.91 -24.49 35.64 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.995 0.518 . . . . 72.42 111.868 174.958 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.1 mptm? -71.83 -73.23 0.19 Allowed 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 121.27 0.557 . . . . 63.53 110.739 169.34 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.568 HH21 ' HG2' ' A' ' 37' ' ' LYS . 18.2 mtp180 -84.41 -53.99 5.07 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 123.941 0.896 . . . . 74.32 112.032 -171.238 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 131.25 163.35 10.87 Favored Glycine 0 N--CA 1.482 1.763 0 CA-C-O 119.525 -0.597 . . . . 73.04 113.076 -179.476 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -67.52 85.7 0.36 Allowed 'Trans proline' 0 C--N 1.379 2.142 0 C-N-CA 122.888 2.392 . . . . 50.33 111.905 173.754 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.2 m -141.72 148.55 39.21 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 124.108 0.963 . . . . 54.13 110.051 -176.802 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 89.9 p -61.76 -31.97 72.2 Favored 'General case' 0 N--CA 1.498 1.945 0 C-N-CA 123.281 0.632 . . . . 64.1 111.478 176.74 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.568 ' HG2' HH21 ' A' ' 32' ' ' ARG . 88.3 tttt -59.17 -34.45 72.13 Favored 'General case' 0 CA--C 1.561 1.397 0 C-N-CA 125.074 1.349 . . . . 71.32 111.751 173.229 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 87.5 m -79.11 -39.33 33.96 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 124.094 0.958 . . . . 72.33 110.18 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 26.7 m-85 -65.86 -26.89 67.85 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 115.179 -0.919 . . . . 72.11 111.95 175.959 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.31 -36.88 84.07 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.338 0.655 . . . . 70.2 111.668 173.206 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -66.44 -54.51 23.31 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 123.116 0.566 . . . . 74.01 110.642 172.005 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 96.1 mt -60.7 -23.06 64.58 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.459 1.104 . . . . 71.32 112.41 178.643 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.65 -57.5 9.86 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.231 0.612 . . . . 72.5 111.467 174.404 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -68.52 -27.58 66.24 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-N 115.544 -0.753 . . . . 75.23 112.161 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.451 ' HD3' HD23 ' A' ' 46' ' ' LEU . 0.6 OUTLIER -70.64 -58.18 3.94 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.731 0.813 . . . . 71.45 109.711 179.608 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.583 HD13 ' HZ3' ' A' ' 17' ' ' TRP . 41.4 mt -83.23 -5.35 59.1 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.475 0.71 . . . . 72.44 112.614 -173.402 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.1 t70 72.73 -2.71 2.58 Favored 'General case' 0 N--CA 1.498 1.935 0 C-N-CA 125.006 1.322 . . . . 64.14 112.146 -177.129 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.469 ' HA ' ' HE2' ' A' ' 48' ' ' LYS . 11.5 mmpt? -97.55 137.58 36.27 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.772 0.829 . . . . 70.03 110.058 -177.142 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 36.0 m-80 -52.19 149.44 9.77 Favored Pre-proline 0 N--CA 1.494 1.767 0 C-N-CA 123.49 0.716 . . . . 72.3 112.645 178.604 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -59.32 -22.12 63.87 Favored 'Trans proline' 0 C--N 1.387 2.601 0 C-N-CA 122.828 2.352 . . . . 52.02 113.082 -176.06 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -68.22 -43.76 77.28 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 124.022 0.929 . . . . 75.34 110.896 172.913 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 11.4 mm-40 -65.73 -41.88 91.7 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.393 0.677 . . . . 72.13 111.076 178.263 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 99.2 t -69.36 -43.83 80.73 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 C-N-CA 123.573 0.749 . . . . 64.24 111.807 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 93.5 p -62.67 -39.48 94.06 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.097 0.559 . . . . 74.4 111.029 179.514 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -72.5 -36.69 68.46 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 115.824 -0.625 . . . . 70.23 112.01 175.849 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -67.63 -34.97 78.05 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 122.775 0.43 . . . . 74.53 111.398 -179.195 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -53.63 -45.49 70.17 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.808 0.843 . . . . 75.21 110.242 169.718 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 40.4 mt-30 -74.48 -30.33 61.8 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 114.984 -1.007 . . . . 74.23 112.052 178.462 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -68.46 -38.62 81.25 Favored 'General case' 0 N--CA 1.497 1.885 0 C-N-CA 123.908 0.883 . . . . 72.1 110.788 178.804 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.674 HD21 ' HB3' ' A' ' 22' ' ' ASP . 32.7 mt -53.62 -51.77 62.0 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.281 1.032 . . . . 62.5 110.245 168.44 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 45.5 mtt . . . . . 0 CA--C 1.552 1.041 0 N-CA-C 113.335 0.865 . . . . 72.12 113.335 178.406 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 17' ' ' TRP . . . . . 0.434 ' CD2' ' HG3' ' A' ' 56' ' ' ARG . 95.9 m95 . . . . . 0 N--CA 1.481 1.099 0 CA-C-O 120.938 0.399 . . . . 72.3 110.212 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 72.2 p -131.68 168.1 18.32 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.43 1.092 . . . . 72.11 110.521 -172.398 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -56.59 -22.9 36.97 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 123.68 0.792 . . . . 52.21 113.113 -178.776 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.448 ' O ' HG23 ' A' ' 24' ' ' VAL . 10.9 m-80 -71.36 -49.79 38.77 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.54 0.736 . . . . 64.13 110.268 179.615 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.406 ' HB3' HD13 ' A' ' 46' ' ' LEU . 0.4 OUTLIER -72.45 -41.76 65.74 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-N 115.675 -0.693 . . . . 74.02 110.101 -176.524 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.486 ' HB3' HD21 ' A' ' 60' ' ' LEU . 2.1 m-20 -51.31 -44.71 62.0 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 124.735 1.214 . . . . 74.54 111.805 172.253 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 60.6 ttp180 -60.61 -45.88 92.37 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.51 0.724 . . . . 74.24 111.554 175.66 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.448 HG23 ' O ' ' A' ' 20' ' ' ASN . 58.3 t -63.07 -37.0 78.21 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.353 0 C-N-CA 123.567 0.747 . . . . 74.51 111.378 -179.501 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 86.8 mt -64.13 -50.03 78.75 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 C-N-CA 122.813 0.445 . . . . 73.13 110.875 175.7 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 95.3 mt -59.36 -33.08 70.73 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 123.358 0.663 . . . . 63.34 111.946 176.519 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 45.8 tp -69.35 -58.13 4.4 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.41 0.684 . . . . 64.34 110.883 179.368 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.59 ' HA ' ' HB3' ' A' ' 31' ' ' LYS . 75.2 mm-40 -68.26 -23.19 64.75 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.576 0.75 . . . . 71.34 112.614 -177.919 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 54.1 t -68.17 -29.05 67.83 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.208 0.603 . . . . 60.02 111.98 174.246 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -104.02 -15.07 15.7 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 123.2 0.6 . . . . 62.33 112.023 176.488 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.59 ' HB3' ' HA ' ' A' ' 28' ' ' GLU . 43.7 tttm -82.65 -49.52 9.72 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 124.154 0.982 . . . . 64.45 110.805 177.025 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 88.4 mtt180 -99.17 -64.11 1.07 Allowed 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.676 0.79 . . . . 52.32 110.303 171.89 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 152.39 173.94 22.44 Favored Glycine 0 CA--C 1.539 1.548 0 CA-C-N 115.266 -0.879 . . . . 73.31 111.912 -172.699 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -86.02 31.46 0.47 Allowed 'Trans proline' 0 CA--C 1.56 1.814 0 C-N-CA 123.002 2.468 . . . . 64.11 113.879 -179.471 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 43.2 t -80.09 161.03 25.56 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 123.358 0.663 . . . . 74.33 112.611 -177.845 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 78.3 p -65.49 -28.19 69.02 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 124.099 0.96 . . . . 73.41 111.93 176.429 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -76.65 -18.97 58.28 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.405 0.682 . . . . 72.34 111.743 176.581 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 56.7 m -82.37 -38.4 24.21 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 109.203 -0.665 . . . . 62.34 109.203 171.494 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -64.76 -29.26 70.23 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 115.658 -0.701 . . . . 73.34 110.977 173.058 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ALA . . . . . 0.419 ' HA ' ' HG3' ' A' ' 50' ' ' PRO . . . -70.97 -34.79 71.76 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.668 0.787 . . . . 72.1 111.548 173.708 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -63.5 -54.96 28.16 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 109.726 -0.472 . . . . 72.42 109.726 171.06 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.437 ' HA ' ' HB3' ' A' ' 45' ' ' LYS . 52.2 mt -59.78 -24.73 64.33 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 125.271 1.428 . . . . 54.14 112.972 179.074 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.37 -55.47 17.99 Favored 'General case' 0 CA--C 1.552 1.03 0 CA-C-O 121.045 0.45 . . . . 53.12 110.742 172.35 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.49 -28.43 67.84 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.537 0.735 . . . . 71.04 112.118 177.568 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.437 ' HB3' ' HA ' ' A' ' 42' ' ' LEU . 23.1 tptm -76.2 -38.43 56.53 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.569 1.148 . . . . 72.32 111.594 -176.09 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.406 HD13 ' HB3' ' A' ' 21' ' ' ASP . 62.6 mt -112.52 11.32 19.74 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.659 0.784 . . . . 51.34 112.443 -173.331 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 64.37 21.71 12.56 Favored 'General case' 0 N--CA 1.506 2.359 0 C-N-CA 124.762 1.225 . . . . 54.43 112.684 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -109.94 -163.2 0.84 Allowed 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.725 0.81 . . . . 71.23 111.796 -175.394 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 -124.87 147.1 55.39 Favored Pre-proline 0 N--CA 1.487 1.385 0 C-N-CA 123.919 0.888 . . . . 75.21 109.984 178.882 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.419 ' HG3' ' HA ' ' A' ' 40' ' ' ALA . 50.6 Cg_exo -55.25 -27.99 59.72 Favored 'Trans proline' 0 C--N 1.382 2.32 0 C-N-CA 123.547 2.831 . . . . 55.14 115.659 -172.14 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -72.13 -44.81 62.55 Favored 'General case' 0 N--CA 1.494 1.768 0 C-N-CA 123.253 0.621 . . . . 64.21 111.117 176.015 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 40.0 mt-30 -57.46 -41.35 80.39 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 123.887 0.875 . . . . 72.21 111.993 172.912 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.413 HG11 ' HB2' ' A' ' 42' ' ' LEU . 66.8 t -69.78 -43.07 80.18 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.032 0 CA-C-N 115.76 -0.655 . . . . 74.45 111.291 177.722 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 45.2 t -60.01 -34.84 73.89 Favored 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 123.721 0.808 . . . . 73.24 111.658 177.332 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.19 -51.37 54.37 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 114.906 -1.043 . . . . 71.24 110.145 177.774 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.434 ' HG3' ' CD2' ' A' ' 17' ' ' TRP . 29.0 mmt-85 -65.8 -30.3 70.91 Favored 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 113.039 0.755 . . . . 63.45 113.039 -179.097 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.411 ' O ' ' HG2' ' A' ' 61' ' ' MET . 19.9 t80 -56.3 -52.94 62.66 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 122.738 0.415 . . . . 75.31 110.502 171.605 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 67.8 mt-30 -73.42 -24.93 60.33 Favored 'General case' 0 CA--C 1.554 1.099 0 CA-C-N 115.574 -0.739 . . . . 72.51 112.074 -176.468 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 21.2 mm-40 -71.27 -43.11 67.82 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.302 0.641 . . . . 72.53 110.166 172.823 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.486 HD21 ' HB3' ' A' ' 22' ' ' ASP . 25.3 mt -58.64 -45.69 88.74 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 124.31 1.044 . . . . 71.32 111.659 174.687 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' MET . . . . . 0.411 ' HG2' ' O ' ' A' ' 57' ' ' PHE . 35.5 mmt . . . . . 0 N--CA 1.482 1.167 0 C-N-CA 123.129 0.572 . . . . 60.25 111.167 175.722 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' TRP . . . . . 0.51 ' HZ2' ' HB3' ' A' ' 52' ' ' GLN . 93.2 m95 . . . . . 0 CA--C 1.56 1.347 0 N-CA-C 110.512 -0.181 . . . . 65.04 110.512 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 80.6 p -119.54 -174.97 2.85 Favored 'General case' 0 N--CA 1.503 2.191 0 C-N-CA 123.746 0.818 . . . . 72.32 111.848 176.14 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 11.9 ptm180 -77.45 -18.59 57.05 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.243 0.617 . . . . 72.2 112.167 170.242 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.403 ' O ' HG23 ' A' ' 24' ' ' VAL . 77.9 m-20 -67.27 -36.08 80.84 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 123.499 0.719 . . . . 74.15 112.05 -176.887 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.38 -39.86 95.66 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 123.08 0.552 . . . . 74.2 111.035 -177.886 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.616 ' HA ' HD11 ' A' ' 60' ' ' LEU . 27.8 m-20 -49.93 -52.0 36.69 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.695 0.798 . . . . 73.34 111.313 175.487 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 42.0 ttt85 -58.77 -48.67 80.42 Favored 'General case' 0 CA--C 1.559 1.306 0 CA-C-N 114.834 -1.075 . . . . 74.45 112.707 176.327 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 20' ' ' ASN . 89.0 t -65.52 -44.65 94.0 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 C-N-CA 123.896 0.878 . . . . 74.04 112.314 -175.747 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 97.3 mt -69.03 -50.24 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.122 0 C-N-CA 123.711 0.804 . . . . 74.21 111.164 -178.431 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.482 HD11 HD22 ' A' ' 60' ' ' LEU . 95.3 mt -57.79 -27.87 63.5 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 112.421 0.526 . . . . 74.03 112.421 175.616 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.3 tp -74.49 -60.81 2.11 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 122.954 0.502 . . . . 51.13 111.814 177.995 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.413 ' HB2' HD21 ' A' ' 42' ' ' LEU . 71.2 mm-40 -72.4 -26.35 61.84 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 113.335 0.865 . . . . 74.14 113.335 -172.705 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 71.7 m -67.16 -44.38 79.89 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-O 120.948 0.404 . . . . 74.42 111.7 -178.567 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.6 pt20 -79.25 -32.41 43.77 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 122.618 0.367 . . . . 74.12 111.86 177.873 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 28.8 ttpp -80.27 -33.38 37.83 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.322 0.649 . . . . 75.34 112.279 -173.479 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 48.0 mtt180 -102.19 -59.93 1.62 Allowed 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.166 0.586 . . . . 73.53 111.77 179.508 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 164.15 173.34 32.7 Favored Glycine 0 CA--C 1.536 1.37 0 N-CA-C 114.66 0.624 . . . . 60.33 114.66 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -87.65 3.15 6.41 Favored 'Trans proline' 0 CA--C 1.557 1.65 0 C-N-CA 123.47 2.78 . . . . 64.43 114.147 -177.859 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 32.3 t -65.07 151.11 46.86 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 123.782 0.833 . . . . 62.11 112.16 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 89.9 p -65.48 -18.38 65.27 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.314 0.646 . . . . 64.04 111.812 176.444 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.425 ' HD2' ' N ' ' A' ' 37' ' ' LYS . 0.2 OUTLIER -77.83 -15.01 59.38 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.745 0.818 . . . . 65.43 111.936 175.859 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 90.0 m -77.63 -39.55 44.88 Favored 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 108.845 -0.798 . . . . 72.14 108.845 169.817 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -65.38 -30.25 71.05 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.045 0.938 . . . . 75.13 111.313 172.095 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.72 -35.84 65.15 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.454 0.702 . . . . 71.13 111.584 175.852 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 56.1 t80 -65.19 -42.39 93.65 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-O 121.47 0.653 . . . . 65.04 110.602 170.839 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.477 HD23 ' HD3' ' A' ' 45' ' ' LYS . 50.4 mt -64.94 -32.92 74.87 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.842 0.857 . . . . 64.31 111.543 175.638 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.7 -35.56 81.1 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.285 0.634 . . . . 61.44 111.535 174.083 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.71 -45.82 81.29 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.177 0.591 . . . . 60.44 112.07 177.368 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.477 ' HD3' HD23 ' A' ' 42' ' ' LEU . 18.0 ptmt -86.05 -22.99 26.93 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 112.938 0.718 . . . . 72.21 112.938 -174.282 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 92.3 mt -90.55 -10.66 42.67 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.217 0.607 . . . . 74.32 111.475 171.393 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.3 t70 64.7 36.62 8.09 Favored 'General case' 0 CA--C 1.567 1.608 0 C-N-CA 124.269 1.027 . . . . 61.43 111.525 176.975 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -133.23 -168.69 2.13 Favored 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 124.005 0.922 . . . . 71.51 111.996 -176.119 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -85.86 144.98 40.22 Favored Pre-proline 0 N--CA 1.492 1.642 0 C-N-CA 123.335 0.654 . . . . 72.43 111.334 175.669 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -61.33 -31.0 88.62 Favored 'Trans proline' 0 C--N 1.388 2.609 0 C-N-CA 122.911 2.407 . . . . 72.32 112.847 177.932 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -65.79 -37.13 85.47 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.062 0.945 . . . . 71.2 110.855 177.335 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.51 ' HB3' ' HZ2' ' A' ' 17' ' ' TRP . 75.2 mm-40 -75.5 -31.23 60.1 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.508 0.723 . . . . 71.0 112.187 179.193 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 94.8 t -63.32 -40.27 88.42 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 C-N-CA 122.827 0.451 . . . . 63.44 110.293 170.069 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 37.9 t -62.67 -39.46 94.01 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.387 0.675 . . . . 52.44 111.809 177.444 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -53.55 -53.75 47.15 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 121.315 0.579 . . . . 72.31 110.679 174.188 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 9.7 mmm180 -61.1 -41.69 97.14 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 114.634 -1.166 . . . . 72.5 112.919 -178.816 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 40.4 t80 -57.91 -51.12 70.94 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 124.029 0.932 . . . . 73.54 112.442 176.314 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 -74.64 -24.81 58.89 Favored 'General case' 0 CA--C 1.555 1.148 0 CA-C-N 115.775 -0.648 . . . . 74.12 111.744 -176.05 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -75.47 -29.29 59.57 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.09 0.556 . . . . 75.44 110.692 170.068 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.616 HD11 ' HA ' ' A' ' 22' ' ' ASP . 9.8 mt -66.04 -41.75 90.47 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.827 0.851 . . . . 62.32 111.9 175.693 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 25.3 mmt . . . . . 0 N--CA 1.484 1.238 0 CA-C-O 121.198 0.523 . . . . 71.03 111.321 175.996 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 95.6 m95 . . . . . 0 N--CA 1.475 0.81 0 N-CA-C 110.374 -0.232 . . . . 74.34 110.374 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 18' ' ' THR . . . . . 0.508 ' OG1' ' HB2' ' A' ' 21' ' ' ASP . 41.4 p -89.7 148.22 23.41 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 109.081 -0.711 . . . . 74.15 109.081 179.21 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -63.03 -20.09 64.99 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.28 0.632 . . . . 73.0 112.435 -172.44 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.461 ' O ' HG23 ' A' ' 24' ' ' VAL . 9.3 m120 -75.94 -47.09 26.55 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 123.507 0.723 . . . . 74.3 109.908 171.825 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.508 ' HB2' ' OG1' ' A' ' 18' ' ' THR . 0.4 OUTLIER -59.96 -55.79 29.76 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 125.208 1.403 . . . . 74.55 111.783 -173.563 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.565 ' HB2' HD21 ' A' ' 60' ' ' LEU . 1.6 p30 -64.49 -32.51 74.17 Favored 'General case' 0 CA--C 1.557 1.238 0 CA-C-N 115.735 -0.666 . . . . 73.43 112.573 179.786 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -64.58 -38.02 89.57 Favored 'General case' 0 CA--C 1.56 1.335 0 C-N-CA 123.011 0.524 . . . . 74.3 111.395 174.011 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.461 HG23 ' O ' ' A' ' 20' ' ' ASN . 99.1 t -67.69 -32.14 55.48 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 C-N-CA 123.182 0.593 . . . . 74.33 111.239 176.262 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 91.5 mt -56.6 -54.91 23.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 C-N-CA 122.238 0.215 . . . . 71.34 110.907 173.389 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.502 ' HG ' HD13 ' A' ' 60' ' ' LEU . 98.7 mt -57.8 -44.07 86.08 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 123.394 0.678 . . . . 71.1 111.757 176.184 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 39.5 tp -60.57 -49.46 77.46 Favored 'General case' 0 CA--C 1.561 1.397 0 C-N-CA 124.286 1.034 . . . . 62.52 112.452 -177.413 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -77.78 -20.35 53.47 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.575 0.75 . . . . 72.12 112.539 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 69.4 m -74.12 -29.27 61.75 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-O 120.846 0.355 . . . . 73.42 110.732 170.33 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 91.7 mt-30 -75.41 -19.58 59.43 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.215 0.606 . . . . 72.44 111.42 170.998 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 35.8 ttmt -82.88 -69.76 0.6 Allowed 'General case' 0 CA--C 1.559 1.302 0 C-N-CA 123.512 0.725 . . . . 75.23 111.407 173.471 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 51.6 mtp180 -81.07 -42.14 21.49 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.582 0.753 . . . . 74.43 112.699 -174.377 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 122.74 161.08 11.11 Favored Glycine 0 CA--C 1.54 1.609 0 CA-C-O 119.711 -0.494 . . . . 63.31 112.784 -175.335 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -69.27 92.66 0.47 Allowed 'Trans proline' 0 C--N 1.374 1.901 0 C-N-CA 122.608 2.206 . . . . 61.1 111.914 173.849 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 43.6 t -148.47 157.74 43.66 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 123.084 0.554 . . . . 61.02 112.287 -174.634 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 95.4 p -63.63 -29.54 70.77 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 123.569 0.747 . . . . 75.15 111.092 175.748 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -63.57 -34.88 78.78 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.772 0.829 . . . . 64.11 111.019 175.174 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 21.5 m -82.94 -33.32 26.78 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 115.249 -0.887 . . . . 71.11 110.054 -177.741 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -68.63 -38.17 80.29 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.372 0.669 . . . . 54.32 111.104 175.474 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.35 -35.3 75.74 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.378 0.671 . . . . 61.34 111.275 174.252 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -66.43 -47.71 72.33 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 123.522 0.729 . . . . 65.24 111.435 177.08 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.412 ' HB2' HG11 ' A' ' 53' ' ' VAL . 25.9 mt -69.17 -24.22 64.03 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.49 1.116 . . . . 73.54 111.986 176.347 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.51 -47.34 82.11 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-O 121.091 0.472 . . . . 73.32 110.601 170.005 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -68.09 -39.69 82.81 Favored 'General case' 0 CA--C 1.557 1.213 0 C-N-CA 123.588 0.755 . . . . 71.54 112.058 177.972 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 32.3 ttmt -73.94 -36.51 64.66 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 124.094 0.958 . . . . 52.44 112.223 -176.568 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 82.6 mt -108.27 9.56 27.94 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 112.882 0.697 . . . . 73.44 112.882 -174.202 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 66.71 11.73 8.38 Favored 'General case' 0 N--CA 1.503 2.194 0 C-N-CA 124.73 1.212 . . . . 64.55 112.944 -179.49 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm -91.65 -163.99 1.12 Allowed 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 124.068 0.947 . . . . 74.1 112.049 -175.484 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -124.81 149.75 63.64 Favored Pre-proline 0 CA--C 1.567 1.63 0 C-N-CA 124.087 0.955 . . . . 74.21 109.212 174.464 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -48.68 -44.22 31.68 Favored 'Trans proline' 0 C--N 1.391 2.769 0 C-N-CA 123.782 2.988 . . . . 71.53 115.755 -173.879 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -68.51 -35.22 77.18 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 122.51 0.324 . . . . 73.43 111.315 -179.279 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 -62.69 -45.97 90.34 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 123.345 0.658 . . . . 74.2 111.076 175.941 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.412 HG11 ' HB2' ' A' ' 42' ' ' LEU . 98.8 t -62.2 -40.7 88.6 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.04 0 CA-C-N 115.503 -0.771 . . . . 54.31 111.252 176.525 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.0 t -68.71 -45.13 72.38 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.902 0.881 . . . . 74.22 112.765 -175.711 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -64.88 -42.16 95.06 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 122.694 0.398 . . . . 73.15 110.878 178.518 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 22.3 tpt180 -66.39 -39.34 88.99 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 122.592 0.357 . . . . 70.51 110.785 177.736 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 34.4 t80 -51.24 -53.13 38.3 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 124.57 1.148 . . . . 73.22 112.371 178.796 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -73.66 -23.09 59.8 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 112.72 0.637 . . . . 74.34 112.72 -177.429 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -75.88 -26.0 56.65 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 123.208 0.603 . . . . 74.15 110.783 172.233 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.565 HD21 ' HB2' ' A' ' 22' ' ' ASP . 42.1 mt -74.6 -40.72 61.41 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.818 0.847 . . . . 75.23 110.98 171.587 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 84.0 mtp . . . . . 0 N--CA 1.479 1.018 0 C-N-CA 123.436 0.694 . . . . 62.33 111.202 176.54 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 17' ' ' TRP . . . . . 0.446 ' CH2' ' HG3' ' A' ' 48' ' ' LYS . 99.0 m95 . . . . . 0 C--O 1.241 0.609 0 N-CA-C 110.04 -0.356 . . . . 71.53 110.04 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 21.7 p -111.72 164.28 13.21 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 108.551 -0.907 . . . . 53.42 108.551 174.907 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 27.3 ptt-85 -57.59 -19.84 28.49 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.305 0.642 . . . . 51.12 112.465 178.491 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.444 ' O ' HG23 ' A' ' 24' ' ' VAL . 28.0 m-80 -70.86 -49.31 47.44 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.45 0.7 . . . . 64.41 110.754 174.556 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -62.24 -57.05 12.86 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.676 0.79 . . . . 71.24 112.272 -176.812 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.462 ' HB2' HD11 ' A' ' 60' ' ' LEU . 2.2 p30 -64.68 -31.89 73.31 Favored 'General case' 0 CA--C 1.555 1.162 0 C-N-CA 123.335 0.654 . . . . 72.31 112.399 -176.285 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -62.75 -39.24 93.54 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.557 0.743 . . . . 74.4 111.821 174.955 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 20' ' ' ASN . 62.4 t -65.61 -38.45 82.37 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 C-N-CA 122.969 0.508 . . . . 62.43 110.577 174.437 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 70.5 mt -59.87 -47.16 92.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 CA-C-O 120.96 0.409 . . . . 71.41 110.951 174.641 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.44 HD11 HD22 ' A' ' 60' ' ' LEU . 88.9 mt -62.86 -36.81 84.5 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.201 1.0 . . . . 54.33 112.09 178.255 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 53.5 tp -67.71 -53.85 24.22 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.339 0.656 . . . . 73.14 111.289 178.711 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.51 ' HA ' ' HB3' ' A' ' 31' ' ' LYS . 8.2 mm-40 -71.12 -20.78 62.28 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.737 0.815 . . . . 74.04 112.426 -176.971 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 35.7 t -67.05 -30.97 71.18 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.091 0.557 . . . . 53.45 111.699 171.316 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 24.3 mm-40 -96.86 -23.69 16.24 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.0 0.52 . . . . 74.35 111.501 177.598 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.51 ' HB3' ' HA ' ' A' ' 28' ' ' GLU . 58.6 tptt -76.17 -58.01 3.53 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.896 0.879 . . . . 71.21 110.649 179.37 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -90.82 -60.27 1.96 Allowed 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.641 0.777 . . . . 74.24 109.818 176.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 148.15 178.94 23.72 Favored Glycine 0 CA--C 1.536 1.375 0 CA-C-N 115.11 -0.95 . . . . 65.12 112.285 -175.245 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -82.83 35.77 0.59 Allowed 'Trans proline' 0 CA--C 1.562 1.906 0 C-N-CA 123.21 2.606 . . . . 64.33 112.762 174.853 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 30.3 t -72.36 145.54 47.68 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.959 0.904 . . . . 44.42 111.455 -179.342 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 80.2 p -61.3 -31.93 71.77 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.317 0.647 . . . . 74.5 111.311 173.365 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.1 tmtm? -65.34 -33.68 76.55 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 124.406 1.082 . . . . 75.14 110.889 174.657 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 56.2 m -75.04 -38.99 61.27 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.344 0.658 . . . . 45.41 109.786 -179.116 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 28.1 m-85 -67.26 -32.48 73.53 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 123.527 0.731 . . . . 71.41 112.066 174.46 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.14 -34.68 66.23 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.598 0.759 . . . . 64.55 111.324 174.51 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -63.0 -48.81 77.22 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 123.587 0.755 . . . . 72.32 110.536 172.277 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.458 ' HB2' HG11 ' A' ' 53' ' ' VAL . 44.4 mt -64.94 -29.31 70.24 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 124.644 1.178 . . . . 75.03 112.226 177.415 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.76 -50.53 68.69 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.13 0.572 . . . . 55.52 110.993 171.557 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.1 -27.6 62.75 Favored 'General case' 0 CA--C 1.558 1.282 0 C-N-CA 123.16 0.584 . . . . 72.1 112.368 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.53 -51.76 11.08 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.809 0.844 . . . . 55.52 109.959 -178.593 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 63.5 mt -87.1 2.53 49.46 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.872 0.869 . . . . 63.04 111.897 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 62.29 24.02 14.26 Favored 'General case' 0 N--CA 1.497 1.913 0 C-N-CA 124.67 1.188 . . . . 71.31 113.035 178.546 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.446 ' HG3' ' CH2' ' A' ' 17' ' ' TRP . 72.2 mmtt -96.94 -167.62 1.58 Allowed 'General case' 0 CA--C 1.558 1.252 0 C-N-CA 124.948 1.299 . . . . 73.43 111.144 177.926 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 24.8 m-80 -105.81 144.55 29.12 Favored Pre-proline 0 N--CA 1.492 1.631 0 C-N-CA 123.683 0.793 . . . . 75.23 110.376 175.933 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -63.32 -29.8 72.9 Favored 'Trans proline' 0 C--N 1.384 2.417 0 C-N-CA 122.794 2.329 . . . . 63.04 113.037 -175.71 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -61.12 -49.69 76.23 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.014 0.926 . . . . 73.21 110.334 174.748 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.467 ' O ' ' HG2' ' A' ' 56' ' ' ARG . 25.4 mt-30 -55.4 -55.64 29.36 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 115.391 -0.822 . . . . 75.44 111.492 176.719 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.458 HG11 ' HB2' ' A' ' 42' ' ' LEU . 84.6 t -55.98 -45.79 80.3 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.305 0 C-N-CA 124.036 0.934 . . . . 43.31 112.468 -174.35 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 32.8 t -61.39 -43.84 98.18 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.377 0.671 . . . . 64.11 111.698 178.594 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -65.89 -44.93 83.8 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.352 0.661 . . . . 73.22 111.801 178.907 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.467 ' HG2' ' O ' ' A' ' 52' ' ' GLN . 2.4 mmp_? -65.71 -35.82 81.85 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 122.492 0.317 . . . . 74.12 111.094 -176.35 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.518 ' HA ' HD12 ' A' ' 60' ' ' LEU . 17.0 t80 -53.77 -49.86 67.3 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.959 0.904 . . . . 60.25 111.708 172.241 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -71.8 -25.0 61.82 Favored 'General case' 0 CA--C 1.552 1.034 0 CA-C-N 115.506 -0.77 . . . . 74.3 111.64 -176.608 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -76.29 -39.4 54.31 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.033 0.533 . . . . 70.03 110.527 173.017 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.518 HD12 ' HA ' ' A' ' 57' ' ' PHE . 16.3 mt -54.26 -46.34 72.61 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 124.712 1.205 . . . . 74.21 111.563 177.27 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 31.7 mmt . . . . . 0 N--CA 1.485 1.293 0 C-N-CA 123.77 0.828 . . . . 60.13 111.498 175.946 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 17' ' ' TRP . . . . . 0.474 ' HZ2' ' HB3' ' A' ' 52' ' ' GLN . 96.7 m95 . . . . . 0 N--CA 1.484 1.257 0 N-CA-C 111.407 0.151 . . . . 75.45 111.407 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 25.9 p -103.17 164.6 11.52 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 120.979 0.419 . . . . 75.5 111.111 177.322 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.46 ' HA ' ' HE ' ' A' ' 19' ' ' ARG . 0.4 OUTLIER -60.34 -21.89 62.6 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.965 0.906 . . . . 73.25 112.377 -177.715 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -74.97 -49.51 19.76 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 123.739 0.816 . . . . 61.43 110.902 176.852 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 59.9 m-20 -59.82 -53.32 59.32 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 123.471 0.708 . . . . 71.22 112.092 -175.709 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.601 ' HB2' HD21 ' A' ' 60' ' ' LEU . 2.9 p30 -62.66 -32.42 73.47 Favored 'General case' 0 CA--C 1.561 1.372 0 CA-C-N 115.371 -0.832 . . . . 61.11 112.216 -177.579 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 35.7 ttm180 -70.54 -40.39 73.44 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.764 0.825 . . . . 73.04 111.57 176.758 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 45.8 t -61.81 -39.6 84.01 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.344 0 C-N-CA 123.665 0.786 . . . . 74.41 111.22 175.693 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 90.8 mt -56.24 -53.96 33.41 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 C-N-CA 123.206 0.602 . . . . 64.43 111.219 174.306 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 96.5 mt -62.49 -46.85 86.57 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.267 0.627 . . . . 75.15 112.18 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 49.1 tp -61.89 -50.3 72.75 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.973 0.909 . . . . 71.53 112.145 -174.644 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.522 ' HB2' HD21 ' A' ' 42' ' ' LEU . 31.1 mt-10 -76.85 -18.27 58.47 Favored 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 112.757 0.651 . . . . 74.23 112.757 -179.01 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 61.9 m -70.02 -29.43 66.48 Favored 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 122.508 0.323 . . . . 63.44 111.108 165.39 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 -83.7 -20.58 33.25 Favored 'General case' 0 N--CA 1.492 1.626 0 C-N-CA 122.901 0.481 . . . . 74.45 111.984 174.054 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -74.05 -44.72 53.28 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 122.996 0.519 . . . . 73.21 110.422 171.818 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 73.9 mtp180 -108.83 -70.98 0.78 Allowed 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.641 0.776 . . . . 75.21 111.954 -173.202 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 155.62 147.57 4.76 Favored Glycine 0 CA--C 1.54 1.617 0 CA-C-O 119.059 -0.856 . . . . 34.12 112.197 -175.292 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -65.67 86.2 0.22 Allowed 'Trans proline' 0 C--N 1.378 2.116 0 C-N-CA 123.234 2.623 . . . . 71.25 112.622 175.482 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 29.3 t -130.26 155.36 46.42 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 124.023 0.929 . . . . 62.43 110.818 -177.544 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 81.9 p -66.89 -29.41 69.3 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.259 0.623 . . . . 65.5 111.671 176.74 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -68.26 -32.06 71.97 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.148 0.579 . . . . 72.54 110.849 172.258 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 66.8 m -79.79 -33.51 40.47 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.218 0.607 . . . . 70.31 109.604 -179.295 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -69.43 -32.77 71.94 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.396 0.678 . . . . 73.51 111.048 173.195 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.8 -35.2 72.43 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.533 0.733 . . . . 75.12 111.287 173.409 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -62.93 -50.57 70.3 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.478 0.711 . . . . 73.11 111.121 172.075 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.522 HD21 ' HB2' ' A' ' 28' ' ' GLU . 54.8 mt -66.44 -23.38 66.28 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 124.411 1.085 . . . . 60.13 111.894 178.697 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.12 -45.99 82.83 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.15 0.58 . . . . 65.11 111.166 169.412 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.1 -32.56 65.05 Favored 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 123.347 0.659 . . . . 71.35 111.953 176.728 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.45 ' HB3' ' HA ' ' A' ' 42' ' ' LEU . 23.8 tptp -76.92 -34.24 57.69 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.906 1.282 . . . . 73.03 111.677 -173.917 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 92.2 mt -102.82 -5.24 23.84 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 123.73 0.812 . . . . 65.32 112.14 175.861 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.3 t70 65.2 31.53 10.72 Favored 'General case' 0 CA--C 1.574 1.883 0 C-N-CA 124.583 1.153 . . . . 70.4 111.215 -178.162 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -110.03 -177.2 3.19 Favored 'General case' 0 N--CA 1.495 1.812 0 C-N-CA 124.53 1.132 . . . . 75.32 111.984 -178.959 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -85.98 140.98 35.13 Favored Pre-proline 0 N--CA 1.489 1.489 0 C-N-CA 123.293 0.637 . . . . 72.41 110.853 173.115 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -66.63 -24.68 47.84 Favored 'Trans proline' 0 C--N 1.38 2.222 0 C-N-CA 122.4 2.067 . . . . 44.24 113.039 -177.39 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -67.34 -47.05 71.64 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.522 0.729 . . . . 64.03 110.186 173.293 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.474 ' HB3' ' HZ2' ' A' ' 17' ' ' TRP . 84.2 mm-40 -60.62 -32.5 71.64 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.695 0.798 . . . . 55.22 112.081 177.112 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.479 HG11 ' HB2' ' A' ' 42' ' ' LEU . 88.8 t -74.95 -45.12 43.9 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.224 0 C-N-CA 123.859 0.864 . . . . 64.01 111.681 177.979 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 87.4 p -63.91 -42.51 97.38 Favored 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 123.1 0.56 . . . . 74.23 111.318 -179.639 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -60.61 -41.29 94.47 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.714 0.805 . . . . 73.5 111.432 172.419 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 1.2 tpp180 -64.16 -42.86 96.56 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 122.985 0.514 . . . . 74.33 111.736 -174.023 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -51.38 -48.65 62.48 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 124.002 0.921 . . . . 73.44 111.626 173.271 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -73.27 -32.52 64.71 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-N 115.551 -0.75 . . . . 75.24 112.301 -174.963 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 17.6 mm-40 -70.94 -41.76 70.71 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.296 0.638 . . . . 74.21 110.479 175.24 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.601 HD21 ' HB2' ' A' ' 22' ' ' ASP . 7.5 mt -53.11 -44.11 67.38 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 124.908 1.283 . . . . 62.13 112.787 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 31.6 mmt . . . . . 0 CA--C 1.558 1.288 0 O-C-N 123.962 0.789 . . . . 74.53 111.11 177.075 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 85.1 m95 . . . . . 0 N--CA 1.478 0.959 0 N-CA-C 109.869 -0.419 . . . . 71.25 109.869 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 24.8 p -98.47 156.61 16.69 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 109.293 -0.632 . . . . 52.22 109.293 176.06 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 6.3 ptm180 -58.47 -21.16 50.6 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 113.869 1.062 . . . . 73.44 113.869 -173.77 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.445 ' O ' HG23 ' A' ' 24' ' ' VAL . 66.8 t30 -74.32 -49.16 24.1 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 122.784 0.433 . . . . 73.13 110.403 176.582 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.6 -58.09 9.57 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.24 1.016 . . . . 74.23 113.287 -177.88 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.577 ' HB2' HD11 ' A' ' 60' ' ' LEU . 3.0 p30 -63.36 -31.73 72.97 Favored 'General case' 0 CA--C 1.56 1.342 0 C-N-CA 122.748 0.419 . . . . 63.23 111.914 -177.752 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 42.7 ttt-85 -64.97 -35.48 81.32 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 123.261 0.624 . . . . 72.24 111.541 174.862 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.445 HG23 ' O ' ' A' ' 20' ' ' ASN . 90.2 t -70.77 -33.77 53.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 C-N-CA 123.276 0.631 . . . . 44.33 111.017 174.783 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 95.0 mt -57.93 -46.99 87.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 CA-C-O 120.707 0.289 . . . . 71.5 110.419 172.503 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.638 HD21 ' HB3' ' A' ' 60' ' ' LEU . 96.1 mt -60.77 -38.5 85.48 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.845 0.858 . . . . 71.55 112.313 176.392 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 40.4 tp -68.9 -47.44 65.8 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.462 0.705 . . . . 71.24 111.733 -179.434 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -75.69 -23.59 56.19 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.301 0.64 . . . . 74.24 111.913 -179.19 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.455 ' SG ' ' HE1' ' A' ' 57' ' ' PHE . 34.7 t -64.76 -31.03 72.07 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.417 0.687 . . . . 74.24 111.284 171.816 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -88.58 -31.53 18.57 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.467 0.707 . . . . 73.11 111.648 176.222 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -78.63 -70.17 0.51 Allowed 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.0 0.52 . . . . 61.14 111.105 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 7.2 mpt_? -70.46 -28.62 65.15 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.688 0.795 . . . . 73.41 112.102 178.569 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.16 167.8 35.87 Favored Glycine 0 CA--C 1.536 1.348 0 CA-C-O 119.493 -0.615 . . . . 63.2 112.579 -175.491 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_exo -72.62 87.72 0.94 Allowed 'Trans proline' 0 C--N 1.373 1.841 0 C-N-CA 122.606 2.204 . . . . 65.54 111.956 175.022 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.8 t -135.56 158.36 44.59 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.356 0.662 . . . . 72.22 111.515 -177.509 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 64.4 p -63.65 -38.66 91.96 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.701 0.8 . . . . 74.14 111.863 177.647 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 57.8 pttt -73.55 -11.15 60.35 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 123.283 0.633 . . . . 70.42 112.382 177.253 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 56.6 m -78.36 -40.38 36.52 Favored 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 108.97 -0.752 . . . . 73.12 108.97 174.936 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 49.1 m-85 -65.91 -33.37 75.67 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.673 0.789 . . . . 73.13 111.145 173.506 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.82 -41.46 83.04 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.361 0.664 . . . . 62.13 111.39 174.672 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -62.07 -50.4 72.1 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 122.883 0.473 . . . . 75.02 110.59 173.725 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.402 ' HA ' ' HB3' ' A' ' 45' ' ' LYS . 59.4 mt -63.33 -23.71 67.54 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 124.84 1.256 . . . . 72.23 112.7 178.627 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ALA . . . . . 0.556 ' HA ' ' O ' ' A' ' 48' ' ' LYS . . . -65.59 -50.85 63.6 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.135 0.574 . . . . 73.15 111.45 173.956 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.79 -28.26 61.56 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-N 115.907 -0.588 . . . . 53.53 111.956 176.48 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.402 ' HB3' ' HA ' ' A' ' 42' ' ' LEU . 23.1 tptm -71.19 -47.38 57.84 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 124.403 1.081 . . . . 63.32 111.585 -176.46 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 75.7 mt -107.34 -0.22 22.6 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.754 0.822 . . . . 71.02 112.701 -172.988 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 62.0 33.57 17.2 Favored 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 124.571 1.148 . . . . 73.33 112.074 -176.612 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.556 ' O ' ' HA ' ' A' ' 43' ' ' ALA . 45.6 mmtm -126.48 116.22 20.78 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.811 0.845 . . . . 73.14 109.573 -178.878 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -48.3 148.43 3.26 Favored Pre-proline 0 N--CA 1.502 2.14 0 C-N-CA 123.691 0.797 . . . . 73.32 112.954 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -53.82 -31.67 63.07 Favored 'Trans proline' 0 C--N 1.387 2.557 0 C-N-CA 123.285 2.657 . . . . 74.51 115.041 -168.224 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 25.3 m-80 -63.62 -38.87 92.74 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 123.154 0.582 . . . . 74.34 111.511 178.651 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -62.41 -43.09 99.65 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.971 0.908 . . . . 75.31 110.229 178.21 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 57.6 t -68.81 -42.68 82.86 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.982 0 CA-C-N 114.261 -1.336 . . . . 75.33 111.716 -177.601 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 58.0 m -64.19 -36.36 83.79 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.996 0.918 . . . . 54.01 112.789 -177.05 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -63.58 -46.8 84.19 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 122.797 0.439 . . . . 72.32 111.084 175.063 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 17.2 mmt180 -70.67 -27.76 64.27 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 112.708 0.632 . . . . 75.32 112.708 178.227 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.455 ' HE1' ' SG ' ' A' ' 29' ' ' CYS . 22.8 t80 -56.38 -55.52 32.49 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.078 0.551 . . . . 72.54 110.735 175.162 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -71.69 -25.99 62.32 Favored 'General case' 0 CA--C 1.554 1.111 0 CA-C-N 115.232 -0.895 . . . . 70.1 111.637 -178.502 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -72.39 -38.87 68.36 Favored 'General case' 0 CA--C 1.556 1.19 0 C-N-CA 124.818 1.247 . . . . 74.32 109.684 179.198 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.638 ' HB3' HD21 ' A' ' 26' ' ' LEU . 44.3 mt -73.98 -37.43 64.48 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.758 1.223 . . . . 72.03 111.716 177.612 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 29.4 mmt . . . . . 0 N--CA 1.487 1.398 0 C-N-CA 122.909 0.484 . . . . 65.34 111.436 174.93 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 90.3 m95 . . . . . 0 CA--C 1.542 0.651 0 N-CA-C 109.907 -0.405 . . . . 74.34 109.907 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 37.7 p -103.53 167.37 9.85 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.262 0.625 . . . . 62.41 111.597 -175.22 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.447 ' O ' ' HB2' ' A' ' 23' ' ' ARG . 16.5 ptm180 -62.28 -21.49 65.26 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-N 115.268 -0.878 . . . . 70.54 112.303 174.575 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -77.66 -45.21 25.67 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 123.721 0.808 . . . . 71.31 110.842 174.778 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.471 ' HA ' HD22 ' A' ' 46' ' ' LEU . 76.7 m-20 -60.26 -58.84 6.8 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.051 0.54 . . . . 62.24 112.079 -176.801 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -66.87 -30.73 70.97 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 123.498 0.719 . . . . 75.33 111.704 -172.559 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.447 ' HB2' ' O ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -60.77 -49.61 76.82 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.993 0.917 . . . . 72.32 111.448 175.814 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 89.2 t -69.95 -32.18 50.62 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 CA-C-N 114.587 -1.188 . . . . 74.41 110.889 -179.644 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.403 ' HA ' HD13 ' A' ' 42' ' ' LEU . 66.4 mt -56.3 -56.28 14.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 C-N-CA 122.491 0.317 . . . . 54.45 110.7 172.852 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 96.0 mt -58.08 -45.4 87.22 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.317 0.647 . . . . 74.53 112.472 179.58 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 32.2 tp -64.92 -50.05 67.99 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.094 0.557 . . . . 71.23 112.274 -174.774 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -78.41 -23.26 46.81 Favored 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 123.033 0.533 . . . . 74.52 112.42 -178.842 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.491 ' HA ' HG21 ' A' ' 38' ' ' THR . 53.3 t -73.04 -31.46 64.45 Favored 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 122.933 0.493 . . . . 73.11 111.549 177.26 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -87.08 7.4 28.04 Favored 'General case' 0 N--CA 1.486 1.363 0 CA-C-O 120.668 0.27 . . . . 54.12 111.259 173.537 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.8 ttmp? -110.03 -53.27 2.69 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 123.871 0.868 . . . . 73.51 111.233 -178.424 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -100.86 9.14 42.7 Favored 'General case' 0 N--CA 1.497 1.889 0 C-N-CA 123.583 0.753 . . . . 73.43 112.22 177.687 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 87.88 160.39 35.62 Favored Glycine 0 CA--C 1.544 1.881 0 CA-C-O 119.944 -0.365 . . . . 74.34 113.75 -178.606 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.439 ' HA ' ' SG ' ' A' ' 29' ' ' CYS . 53.2 Cg_endo -84.9 40.51 0.84 Allowed 'Trans proline' 0 C--N 1.37 1.687 0 C-N-CA 123.247 2.631 . . . . 61.21 113.691 -177.743 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 47.4 m -107.43 171.64 7.27 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 123.614 0.765 . . . . 51.22 112.384 -175.03 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 88.7 p -61.58 -24.27 66.55 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 123.789 0.835 . . . . 74.12 112.776 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -49.66 -45.27 48.41 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 124.471 1.108 . . . . 74.44 111.68 170.526 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.491 HG21 ' HA ' ' A' ' 29' ' ' CYS . 17.7 m -88.35 -33.97 17.77 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 114.806 -1.088 . . . . 74.35 110.9 -173.758 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 -67.79 -35.48 78.74 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.004 0.521 . . . . 75.25 112.251 -179.813 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.2 -36.43 69.19 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.387 0.613 . . . . 42.24 111.411 174.37 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 20.9 t80 -59.69 -49.43 77.77 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 124.236 1.014 . . . . 73.01 111.463 172.361 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.483 ' HB2' HG11 ' A' ' 53' ' ' VAL . 59.8 mt -70.52 -26.28 63.51 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 124.308 1.043 . . . . 72.21 112.008 178.698 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.1 -56.32 22.27 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 122.892 0.477 . . . . 74.31 111.327 174.723 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.57 -28.64 68.69 Favored 'General case' 0 N--CA 1.485 1.296 0 N-CA-C 112.363 0.505 . . . . 62.53 112.363 178.143 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.5 tptp -69.96 -45.79 66.65 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.114 0.565 . . . . 74.02 112.104 178.209 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.555 ' HB2' ' HG2' ' A' ' 48' ' ' LYS . 28.8 mt -99.09 0.94 44.67 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.26 0.624 . . . . 73.12 112.153 -173.605 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 25.8 t70 69.45 26.98 5.06 Favored 'General case' 0 CA--C 1.569 1.709 0 C-N-CA 125.115 1.366 . . . . 74.35 111.831 -178.71 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.555 ' HG2' ' HB2' ' A' ' 46' ' ' LEU . 63.2 mmtt -101.8 -174.89 2.7 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 123.682 0.793 . . . . 45.44 111.458 179.258 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -100.13 151.35 37.49 Favored Pre-proline 0 N--CA 1.49 1.557 0 C-N-CA 123.821 0.848 . . . . 71.22 109.285 167.909 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -61.83 -33.53 84.58 Favored 'Trans proline' 0 C--N 1.382 2.306 0 C-N-CA 122.721 2.281 . . . . 74.05 113.35 -176.102 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 -65.99 -39.19 90.1 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.666 0.786 . . . . 70.33 111.538 177.437 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -69.42 -38.72 78.02 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.489 0.716 . . . . 74.4 111.339 -179.738 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.483 HG11 ' HB2' ' A' ' 42' ' ' LEU . 95.0 t -65.42 -41.42 91.07 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 C-N-CA 123.436 0.694 . . . . 60.53 110.872 174.382 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.8 t -60.05 -42.33 94.23 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.563 0.745 . . . . 53.23 111.311 176.491 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -64.81 -49.6 70.01 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 115.837 -0.619 . . . . 75.22 111.547 175.024 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.47 ' O ' ' HB2' ' A' ' 60' ' ' LEU . 3.3 tpm_? -57.21 -41.98 80.43 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 122.998 0.519 . . . . 73.23 111.912 -178.002 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -59.07 -54.92 41.58 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.983 0.913 . . . . 72.33 112.24 177.441 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -73.35 -28.9 62.3 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.012 0.525 . . . . 74.45 111.95 -173.302 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 56.5 mt-30 -64.72 -46.14 83.55 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 122.947 0.499 . . . . 71.51 110.003 167.011 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.47 ' HB2' ' O ' ' A' ' 56' ' ' ARG . 0.8 OUTLIER -60.38 -38.35 83.66 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 124.256 1.022 . . . . 71.33 111.238 -177.6 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 21.7 mmt . . . . . 0 N--CA 1.481 1.107 0 C-N-CA 123.276 0.631 . . . . 55.14 111.869 176.973 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 17' ' ' TRP . . . . . 0.549 ' HE1' ' HG3' ' A' ' 56' ' ' ARG . 98.6 m95 . . . . . 0 N--CA 1.482 1.167 0 CA-C-O 120.835 0.35 . . . . 62.42 110.434 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 14.0 p -103.8 160.91 14.38 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 108.382 -0.97 . . . . 61.25 108.382 164.744 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 36.7 ptt-85 -57.0 -26.05 59.58 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 123.309 0.644 . . . . 73.31 111.886 177.352 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.438 ' O ' HG23 ' A' ' 24' ' ' VAL . 22.3 m-80 -75.52 -37.25 60.21 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.016 0.927 . . . . 75.45 110.911 -179.888 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -68.37 -47.71 66.68 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 112.961 0.726 . . . . 64.22 112.961 -177.487 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -65.54 -30.36 71.1 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 120.872 0.368 . . . . 72.03 111.38 176.829 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -62.32 -44.29 96.84 Favored 'General case' 0 N--CA 1.484 1.226 0 CA-C-N 116.421 -0.354 . . . . 73.04 111.053 168.717 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 20' ' ' ASN . 68.1 t -63.17 -34.28 65.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 C-N-CA 123.351 0.66 . . . . 74.03 111.169 176.676 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 88.0 mt -61.32 -44.03 97.7 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.502 0 C-N-CA 122.581 0.353 . . . . 72.23 111.222 173.762 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.442 ' HG ' HD13 ' A' ' 60' ' ' LEU . 94.0 mt -72.19 -28.53 63.26 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.609 0.764 . . . . 72.14 112.537 174.644 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 47.5 tp -68.01 -52.01 40.53 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 124.211 1.004 . . . . 53.52 110.325 178.86 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -76.97 -16.21 59.41 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 114.922 -1.035 . . . . 64.43 112.018 178.968 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 46.1 t -60.61 -32.85 71.97 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 123.076 0.55 . . . . 74.43 111.842 167.131 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 9.6 mm100 -91.14 -18.21 24.86 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 122.686 0.394 . . . . 75.01 110.973 176.987 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.403 ' HG3' ' NH1' ' A' ' 32' ' ' ARG . 54.1 tptt -74.67 -34.15 62.62 Favored 'General case' 0 CA--C 1.559 1.307 0 C-N-CA 124.09 0.956 . . . . 74.01 110.801 174.15 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.403 ' NH1' ' HG3' ' A' ' 31' ' ' LYS . 2.8 mpt_? -126.14 -73.77 0.62 Allowed 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.81 0.844 . . . . 74.13 110.561 174.859 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 150.37 167.33 14.31 Favored Glycine 0 N--CA 1.479 1.566 0 CA-C-O 119.056 -0.858 . . . . 52.22 111.574 -172.062 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.27 74.89 2.46 Favored 'Trans proline' 0 CA--C 1.564 1.991 0 CA-C-N 120.49 2.145 . . . . 72.41 112.363 173.138 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 42.5 t -123.38 164.18 19.36 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 124.302 1.041 . . . . 74.52 111.671 -173.211 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 79.8 p -62.94 -40.62 98.22 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 124.391 1.076 . . . . 64.25 111.621 179.531 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -66.25 -25.76 67.04 Favored 'General case' 0 N--CA 1.485 1.315 0 CA-C-N 115.541 -0.754 . . . . 62.44 112.072 176.075 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 20.8 m -83.87 -32.24 25.3 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.388 0.675 . . . . 74.51 110.394 -177.092 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -61.23 -40.22 93.2 Favored 'General case' 0 CA--C 1.555 1.156 0 C-N-CA 122.84 0.456 . . . . 74.22 110.304 170.374 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.71 -34.72 62.66 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.04 0.936 . . . . 73.3 111.957 177.479 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -64.84 -46.26 82.65 Favored 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 124.19 0.996 . . . . 73.54 110.989 177.19 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.476 ' HB2' HG11 ' A' ' 53' ' ' VAL . 42.7 mt -73.61 -25.61 60.41 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.417 1.087 . . . . 53.41 112.259 175.42 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.91 -42.64 94.56 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-O 120.872 0.368 . . . . 72.12 110.576 171.027 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -71.07 -36.93 72.45 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.682 0.793 . . . . 51.42 112.133 176.73 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 9.0 tmtm? -77.1 -41.62 41.37 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.908 0.883 . . . . 53.21 111.583 -174.257 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.434 ' HB3' ' HZ3' ' A' ' 17' ' ' TRP . 83.8 mt -99.6 -1.6 37.74 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.482 0.713 . . . . 53.34 112.02 -176.328 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 36.7 t70 55.58 65.2 1.53 Allowed 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 124.868 1.267 . . . . 73.42 112.815 179.43 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.44 ' HG3' ' CH2' ' A' ' 17' ' ' TRP . 68.1 mmtt -141.48 175.86 9.34 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 124.864 1.265 . . . . 51.24 109.922 172.643 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 65.2 m-80 -75.23 149.59 84.72 Favored Pre-proline 0 CA--C 1.559 1.291 0 N-CA-C 110.158 -0.312 . . . . 74.11 110.158 168.733 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -54.86 -29.66 64.39 Favored 'Trans proline' 0 C--N 1.387 2.571 0 C-N-CA 122.998 2.465 . . . . 64.1 114.482 -178.256 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -65.16 -41.02 95.08 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 123.612 0.765 . . . . 74.22 111.561 176.539 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 76.7 mm-40 -64.89 -36.79 85.51 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.427 0.691 . . . . 72.43 111.179 -176.878 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.476 HG11 ' HB2' ' A' ' 42' ' ' LEU . 82.4 t -72.51 -50.78 32.51 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.951 0 CA-C-N 115.161 -0.927 . . . . 71.1 111.045 172.391 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 46.6 t -60.16 -49.47 77.49 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 124.388 1.075 . . . . 62.52 112.884 -169.963 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.45 ' O ' ' HG2' ' A' ' 59' ' ' GLN . 31.4 mm-40 -56.51 -47.71 78.76 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.412 0.685 . . . . 62.05 111.833 177.703 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.549 ' HG3' ' HE1' ' A' ' 17' ' ' TRP . 10.1 mmm180 -71.91 -28.15 63.29 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.731 0.812 . . . . 74.2 112.843 -179.125 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -66.87 -41.29 87.51 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 108.716 -0.846 . . . . 65.55 108.716 173.302 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -69.33 -29.65 67.53 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 115.356 -0.838 . . . . 72.24 111.642 175.826 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' GLN . . . . . 0.45 ' HG2' ' O ' ' A' ' 55' ' ' GLU . 13.3 mm100 -66.99 -41.58 86.5 Favored 'General case' 0 N--CA 1.49 1.57 0 CA-C-O 121.203 0.525 . . . . 72.14 109.832 176.071 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.442 HD13 ' HG ' ' A' ' 26' ' ' LEU . 69.2 mt -59.57 -43.76 93.5 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 114.989 -1.005 . . . . 74.44 111.059 174.225 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 23.6 mmt . . . . . 0 N--CA 1.49 1.529 0 C-N-CA 123.266 0.626 . . . . 64.32 112.325 176.828 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 80.8 m95 . . . . . 0 N--CA 1.48 1.03 0 CA-C-O 121.093 0.473 . . . . 74.23 111.434 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 58.2 p -107.58 166.11 10.92 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.333 0.653 . . . . 44.52 110.949 177.282 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 17.1 ptp180 -57.91 -21.16 42.09 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 124.198 0.999 . . . . 72.11 112.276 174.015 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -76.58 -46.04 27.86 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 124.084 0.954 . . . . 60.03 110.724 174.658 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 39.2 m-20 -59.7 -57.03 14.67 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.25 0.62 . . . . 75.22 111.735 178.685 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.629 ' HB2' HD21 ' A' ' 60' ' ' LEU . 2.6 p30 -64.97 -31.74 73.13 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 113.209 0.818 . . . . 73.3 113.209 -174.916 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 48.2 ttt180 -62.28 -42.11 99.06 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 122.893 0.477 . . . . 73.52 111.018 175.922 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.463 ' HB ' HD21 ' A' ' 46' ' ' LEU . 92.7 t -71.36 -33.09 48.95 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 C-N-CA 123.455 0.702 . . . . 72.11 111.487 177.992 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 94.5 mt -57.65 -57.38 10.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 CA-C-O 120.886 0.374 . . . . 64.31 110.278 172.402 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.436 ' HG ' HD13 ' A' ' 60' ' ' LEU . 90.6 mt -61.89 -33.28 73.94 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 115.636 -0.711 . . . . 71.21 112.174 178.656 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 56.0 tp -61.76 -54.46 42.08 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.803 0.841 . . . . 71.32 111.533 179.047 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.524 ' HA ' ' HB3' ' A' ' 31' ' ' LYS . 59.3 mm-40 -75.13 -22.94 57.85 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 113.045 0.757 . . . . 75.23 113.045 -178.679 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 89.6 m -69.83 -30.13 67.56 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 122.775 0.43 . . . . 54.11 111.307 171.782 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -91.92 -20.38 21.47 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.346 0.658 . . . . 71.25 111.882 173.87 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.524 ' HB3' ' HA ' ' A' ' 28' ' ' GLU . 58.8 tptt -80.66 -67.21 0.79 Allowed 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.641 0.777 . . . . 73.1 110.545 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 45.2 mtt85 -92.51 -40.38 10.85 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.03 0.932 . . . . 72.03 111.74 -178.34 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 138.48 163.07 9.43 Favored Glycine 0 N--CA 1.481 1.658 0 CA-C-O 119.528 -0.596 . . . . 52.14 112.556 -178.384 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -83.2 36.37 0.61 Allowed 'Trans proline' 0 CA--C 1.561 1.858 0 C-N-CA 123.017 2.478 . . . . 71.04 113.815 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 79.1 p -80.59 161.44 24.73 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.589 0.756 . . . . 75.24 111.732 -177.745 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 99.0 p -67.05 -23.77 65.91 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.04 0.536 . . . . 72.11 111.587 174.745 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -69.8 -32.04 70.28 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.531 0.732 . . . . 65.13 111.492 173.725 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 86.3 m -78.04 -37.17 47.45 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.048 0.539 . . . . 72.31 109.636 178.228 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -64.7 -32.08 73.59 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.405 0.682 . . . . 73.42 111.39 172.588 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.62 -39.51 88.36 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 123.415 0.686 . . . . 74.33 111.26 173.527 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -63.05 -49.16 75.67 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.264 0.625 . . . . 72.2 110.797 172.087 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 77.9 mt -63.62 -23.76 67.52 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 124.79 1.236 . . . . 65.11 113.032 -179.652 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.75 -55.03 34.52 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 123.088 0.555 . . . . 45.5 110.998 170.295 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.67 -27.83 62.34 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.586 0.754 . . . . 64.04 112.351 179.223 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -75.91 -39.02 57.1 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.184 0.993 . . . . 71.32 111.325 -177.109 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.463 HD21 ' HB ' ' A' ' 24' ' ' VAL . 91.0 mt -106.26 12.75 29.66 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.759 0.824 . . . . 72.54 112.687 -177.312 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.0 p30 51.37 23.95 1.95 Allowed 'General case' 0 N--CA 1.501 2.117 0 C-N-CA 125.548 1.539 . . . . 75.41 114.09 -174.743 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -106.82 -175.01 2.67 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 123.615 0.766 . . . . 71.42 111.565 -178.221 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 47.5 m-80 -96.55 143.84 26.82 Favored Pre-proline 0 N--CA 1.492 1.628 0 C-N-CA 123.084 0.554 . . . . 74.14 110.431 173.996 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -66.24 -26.74 48.96 Favored 'Trans proline' 0 C--N 1.379 2.137 0 C-N-CA 122.653 2.235 . . . . 42.24 113.512 -171.983 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -71.76 -38.77 70.33 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.46 0.704 . . . . 74.32 111.32 178.264 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 12.0 mp0 -70.75 -35.14 72.5 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.174 0.59 . . . . 73.34 110.849 176.742 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 86.1 t -62.4 -47.36 93.37 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 C-N-CA 123.375 0.67 . . . . 61.51 111.26 174.475 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 90.9 p -65.67 -41.7 92.18 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.35 0.66 . . . . 74.11 112.161 -177.239 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -64.92 -48.97 72.25 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 122.675 0.39 . . . . 72.42 111.63 177.018 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.46 ' NH1' ' HB3' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -70.08 -23.98 63.16 Favored 'General case' 0 CA--C 1.561 1.368 0 C-N-CA 123.313 0.645 . . . . 72.53 111.215 -177.079 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.484 ' HA ' HD12 ' A' ' 60' ' ' LEU . 23.9 t80 -61.13 -49.29 77.86 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 123.979 0.912 . . . . 75.1 111.556 170.71 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -73.88 -24.42 59.73 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 115.465 -0.789 . . . . 71.1 111.143 -178.801 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -72.35 -32.81 66.79 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.58 0.752 . . . . 75.24 111.102 171.509 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.629 HD21 ' HB2' ' A' ' 22' ' ' ASP . 15.3 mt -58.58 -55.54 33.79 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.415 0.686 . . . . 72.3 111.142 173.218 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 27.9 mmt . . . . . 0 N--CA 1.484 1.259 0 C-N-CA 123.015 0.526 . . . . 72.03 112.018 178.844 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 29.4 m . . . . . 0 N--CA 1.489 1.516 0 CA-C-O 120.314 0.102 . . . . 63.13 110.904 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 48.2 m80 -68.32 151.14 47.34 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.039 0.536 . . . . 73.14 112.181 -179.427 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 60.8 mtt -69.7 104.55 2.44 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 115.585 -0.734 . . . . 63.24 110.295 177.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 40.7 mtmt 68.77 171.71 0.29 Allowed 'General case' 0 N--CA 1.496 1.866 0 C-N-CA 125.114 1.366 . . . . 62.44 112.614 -176.164 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -155.88 147.12 22.52 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.623 0.769 . . . . 73.33 110.762 175.293 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 35.5 m -112.13 4.75 8.33 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 C-N-CA 123.444 0.697 . . . . 61.12 111.765 177.431 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.5 mp -88.79 102.91 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.096 0 C-N-CA 123.345 0.658 . . . . 73.12 109.259 -179.286 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 50.9 tttm -156.91 113.62 3.04 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 122.732 0.413 . . . . 71.15 111.439 -176.021 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.571 ' H ' HD13 ' A' ' 63' ' ' LEU . 59.6 mttp -100.02 167.93 10.17 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.549 0.739 . . . . 72.1 110.955 168.566 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.5 mtpm? -84.62 124.72 31.76 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 123.316 0.646 . . . . 73.11 110.92 178.367 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -98.14 16.59 59.88 Favored Glycine 0 N--CA 1.481 1.638 0 C-N-CA 122.574 0.13 . . . . 64.05 112.778 177.084 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.547 ' HB3' HH21 ' A' ' 56' ' ' ARG . 0.6 OUTLIER -151.26 154.72 37.33 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.872 0.869 . . . . 53.32 111.681 -173.564 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.473 HG22 HG23 ' A' ' 14' ' ' ILE . 3.3 mp -105.96 -50.75 8.25 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.252 0 C-N-CA 124.078 0.951 . . . . 73.13 110.876 -175.672 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.473 HG23 HG22 ' A' ' 13' ' ' ILE . 30.3 pt -122.26 5.7 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.162 0 C-N-CA 123.698 0.799 . . . . 72.12 112.877 -175.722 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 54.9 mt -100.24 139.0 22.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 C-N-CA 123.189 0.595 . . . . 71.3 110.659 -176.498 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 59.8 tp -78.32 103.22 8.12 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.35 0.66 . . . . 73.44 111.766 -176.374 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 90.9 m95 -131.87 128.9 39.6 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.566 0.746 . . . . 74.31 110.389 174.422 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 44.8 p -126.16 169.44 12.83 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.117 0.567 . . . . 65.02 111.201 179.338 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -51.9 -33.11 35.45 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 124.831 1.252 . . . . 74.32 114.063 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.405 ' O ' HG23 ' A' ' 24' ' ' VAL . 14.6 t-20 -73.52 -34.73 65.38 Favored 'General case' 0 CA--C 1.558 1.267 0 C-N-CA 123.094 0.558 . . . . 71.44 111.244 -176.755 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -69.71 -52.38 26.07 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.307 0.643 . . . . 73.01 112.013 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -58.83 -31.63 68.65 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.852 0.861 . . . . 64.53 112.549 -178.843 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 74.4 ttt180 -62.59 -46.2 89.41 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 122.29 0.236 . . . . 71.42 111.068 174.145 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 20' ' ' ASN . 36.8 t -63.37 -39.15 84.21 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 C-N-CA 123.253 0.621 . . . . 74.4 111.092 -179.087 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.417 ' HA ' HD13 ' A' ' 42' ' ' LEU . 87.0 mt -54.81 -57.79 5.79 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.238 0 C-N-CA 123.225 0.61 . . . . 73.13 110.95 175.794 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 94.2 mt -63.05 -34.07 76.79 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.399 0.68 . . . . 55.21 112.142 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 31.7 tp -65.01 -53.39 46.9 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.428 0.691 . . . . 75.43 111.626 -177.259 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 48.1 mm-40 -75.76 -24.63 56.08 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 122.846 0.458 . . . . 74.12 112.2 179.122 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 41.5 t -68.94 -38.5 79.51 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 122.677 0.391 . . . . 64.41 111.364 177.15 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -80.75 -35.18 33.67 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.232 0.613 . . . . 73.35 111.203 177.184 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -64.28 -47.15 80.64 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 123.531 0.732 . . . . 71.41 111.852 177.313 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 36.8 mtt180 -104.6 -68.21 0.86 Allowed 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.649 0.78 . . . . 72.01 110.719 -173.679 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 145.81 135.51 2.81 Favored Glycine 0 CA--C 1.534 1.227 0 CA-C-O 118.885 -0.953 . . . . 74.33 110.912 -172.024 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -66.76 87.75 0.29 Allowed 'Trans proline' 0 CA--C 1.561 1.872 0 C-N-CA 122.716 2.278 . . . . 72.23 113.342 -178.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 98.7 p -126.55 163.45 23.38 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.128 0.971 . . . . 71.52 110.149 178.312 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 68.8 p -55.15 -39.82 69.9 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 123.953 0.901 . . . . 71.23 113.027 -179.39 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 63.7 pttt -73.76 -25.98 60.42 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.496 0.718 . . . . 73.52 112.335 179.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 86.4 m -76.1 -39.56 54.98 Favored 'General case' 0 N--CA 1.484 1.24 0 N-CA-C 108.87 -0.789 . . . . 52.02 108.87 175.556 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -67.16 -28.83 68.45 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 115.322 -0.854 . . . . 72.25 111.254 173.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.09 -35.95 66.71 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.749 0.82 . . . . 65.32 111.863 175.097 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -62.71 -50.37 71.39 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.184 0.594 . . . . 72.31 110.406 171.724 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.439 ' HB2' HG11 ' A' ' 53' ' ' VAL . 76.3 mt -66.21 -25.64 67.02 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.555 1.142 . . . . 70.04 112.192 177.229 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.39 -58.48 5.2 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.315 0.646 . . . . 64.03 111.117 175.284 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.84 -36.15 76.23 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 123.5 0.72 . . . . 51.41 111.945 178.277 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.25 -49.75 70.67 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 124.175 0.99 . . . . 74.1 111.81 176.217 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 52.3 mt -99.5 14.6 29.32 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 113.196 0.813 . . . . 65.31 113.196 -170.819 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 68.25 13.96 9.14 Favored 'General case' 0 N--CA 1.508 2.434 0 C-N-CA 125.071 1.349 . . . . 74.01 113.211 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -103.48 -176.72 3.16 Favored 'General case' 0 N--CA 1.483 1.182 0 CA-C-O 121.768 0.794 . . . . 52.42 112.843 -173.549 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -102.76 153.91 37.88 Favored Pre-proline 0 CA--C 1.559 1.296 0 CA-C-N 115.003 -0.999 . . . . 52.42 109.421 166.484 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_exo -47.11 -35.12 18.7 Favored 'Trans proline' 0 C--N 1.388 2.645 0 C-N-CA 123.623 2.882 . . . . 73.43 114.631 177.174 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.41 ' O ' ' HG3' ' A' ' 55' ' ' GLU . 78.8 m-20 -59.63 -50.55 73.42 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.613 0.765 . . . . 75.5 111.585 176.84 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 83.1 mm-40 -55.83 -46.43 78.13 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 123.56 0.744 . . . . 74.22 112.111 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.439 HG11 ' HB2' ' A' ' 42' ' ' LEU . 76.8 t -64.74 -45.78 94.14 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 CA-C-N 115.163 -0.926 . . . . 60.25 111.631 -178.899 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.3 t -59.47 -44.13 93.08 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.303 0.641 . . . . 62.32 111.941 179.604 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.418 ' O ' ' HG2' ' A' ' 59' ' ' GLN . 60.0 mt-10 -57.78 -50.82 71.97 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.127 0.571 . . . . 73.43 111.435 177.693 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.547 HH21 ' HB3' ' A' ' 12' ' ' GLU . 40.3 mmt-85 -68.78 -35.2 76.75 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 122.677 0.391 . . . . 74.23 111.908 -176.655 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -52.77 -52.77 55.25 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.422 0.689 . . . . 54.24 110.964 170.561 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -69.61 -25.14 63.81 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 115.337 -0.847 . . . . 44.42 112.133 -176.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.453 ' O ' ' HG ' ' A' ' 63' ' ' LEU . 30.9 mm-40 -68.56 -54.42 16.74 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 109.373 -0.602 . . . . 61.1 109.373 172.406 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 21.0 mt -47.61 -48.02 28.53 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 125.02 1.328 . . . . 63.41 112.607 179.015 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 23.7 mmt -58.62 -51.31 70.47 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 123.297 0.639 . . . . 72.43 111.667 178.064 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 58.0 mtpt -65.04 -27.1 68.57 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.848 0.859 . . . . 74.54 112.724 -179.186 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.571 HD13 ' H ' ' A' ' 9' ' ' LYS . 96.0 mt -70.78 -37.42 73.33 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.296 0.638 . . . . 72.12 111.636 175.256 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -74.24 -30.8 62.32 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 122.584 0.354 . . . . 74.05 111.56 177.189 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -78.5 -58.83 3.05 Favored 'General case' 0 CA--C 1.558 1.264 0 C-N-CA 123.192 0.597 . . . . 75.32 112.41 179.091 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.9 mppt? -110.93 -58.55 2.08 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.597 0.759 . . . . 74.0 112.127 -175.474 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 33.9 t 67.53 -66.98 0.19 Allowed 'General case' 0 N--CA 1.501 2.121 0 C-N-CA 125.168 1.387 . . . . 64.51 112.391 -172.803 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp 64.83 -169.98 0.2 Allowed 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 125.136 1.374 . . . . 75.23 112.794 177.317 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 75.8 m -142.15 103.3 4.27 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.181 0.593 . . . . 73.34 110.56 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 25.9 ttm180 . . . . . 0 CA--C 1.561 1.366 0 C-N-CA 123.421 0.688 . . . . 70.32 110.06 178.799 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 23.1 t . . . . . 0 N--CA 1.494 1.726 0 N-CA-C 110.647 -0.131 . . . . 73.21 110.647 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 59.7 m-70 -74.11 85.73 1.85 Allowed 'General case' 0 CA--C 1.555 1.165 0 C-N-CA 123.388 0.675 . . . . 71.22 110.663 -179.31 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 21.3 ttt -110.97 145.09 39.02 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.415 0.686 . . . . 74.53 110.358 -175.048 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 66.5 mmtt 66.18 93.34 0.07 Allowed 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 124.581 1.152 . . . . 74.12 111.684 -171.544 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 41.7 m-20 -95.97 83.38 3.65 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 108.825 -0.805 . . . . 75.33 108.825 173.806 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 46.3 t -70.01 101.11 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.041 0 C-N-CA 123.163 0.585 . . . . 64.24 111.149 -171.757 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 35.3 pt -71.8 148.21 10.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 CA-C-N 115.828 -0.624 . . . . 74.31 111.303 175.306 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.6 pttt -159.93 176.44 11.88 Favored 'General case' 0 N--CA 1.48 1.068 0 CA-C-N 115.784 -0.644 . . . . 75.32 111.936 -171.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.7 pttp -64.19 152.1 41.68 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.223 1.009 . . . . 71.04 113.163 -177.362 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.6 tmtt? -128.27 78.54 1.84 Allowed 'General case' 0 CA--C 1.554 1.126 0 N-CA-C 108.27 -1.011 . . . . 74.13 108.27 172.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -120.91 24.77 7.37 Favored Glycine 0 N--CA 1.477 1.413 0 CA-C-N 115.602 -0.726 . . . . 65.14 112.001 174.803 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -125.86 121.83 34.35 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.197 0.999 . . . . 75.15 110.021 -174.066 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.656 HG22 ' H ' ' A' ' 15' ' ' ILE . 59.0 mt 69.61 137.95 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 C-N-CA 125.526 1.53 . . . . 74.42 112.376 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 32.2 pt -68.24 -22.83 27.88 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 C-N-CA 123.79 0.836 . . . . 52.15 113.159 -178.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.656 ' H ' HG22 ' A' ' 13' ' ' ILE . 16.4 mt -84.84 130.17 36.49 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.194 0 C-N-CA 124.032 0.933 . . . . 74.15 110.223 -178.915 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -79.56 132.25 36.24 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.255 0.622 . . . . 75.12 109.924 175.457 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -137.9 130.39 29.42 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.631 0.772 . . . . 74.34 110.195 176.138 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 30.7 p -135.38 168.57 18.97 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 124.137 0.975 . . . . 60.11 110.448 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 14.5 ptm180 -57.9 -28.33 64.12 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 113.976 1.102 . . . . 73.51 113.976 -171.736 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -68.82 -34.53 75.66 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.263 0.625 . . . . 65.24 111.463 178.002 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.418 ' HA ' HD22 ' A' ' 46' ' ' LEU . 47.8 m-20 -66.48 -57.7 6.79 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.003 0.521 . . . . 74.45 110.718 175.218 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -54.26 -39.01 66.46 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.506 1.122 . . . . 73.11 112.781 -179.471 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 61.3 ttt-85 -60.1 -50.33 74.13 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.191 0.597 . . . . 75.34 111.938 178.392 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 38.4 t -75.0 -31.71 25.63 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 122.708 0.403 . . . . 63.4 111.048 -174.154 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 75.1 mt -60.84 -48.57 88.32 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 C-N-CA 122.146 0.178 . . . . 65.5 110.621 172.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 96.3 mt -66.62 -34.8 78.67 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 123.186 0.594 . . . . 72.42 112.317 177.452 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 64.2 tp -61.87 -48.08 82.13 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.66 0.784 . . . . 74.2 111.298 177.657 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.55 ' HB3' HG23 ' A' ' 38' ' ' THR . 26.4 mm-40 -72.56 -32.42 66.04 Favored 'General case' 0 CA--C 1.551 0.988 0 CA-C-N 114.767 -1.106 . . . . 73.25 112.088 176.284 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.667 ' HG ' ' HE1' ' A' ' 57' ' ' PHE . 13.9 t -65.45 -35.46 80.98 Favored 'General case' 0 N--CA 1.491 1.598 0 C-N-CA 123.714 0.805 . . . . 73.32 112.212 179.478 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -90.39 -3.95 57.37 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.057 0.543 . . . . 55.33 111.963 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 27.0 tptp -113.15 -73.3 0.67 Allowed 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 123.123 0.569 . . . . 71.23 110.74 178.524 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 61.5 mtt180 -81.21 -10.61 59.58 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.257 0.623 . . . . 64.41 112.435 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 82.21 -165.22 44.8 Favored Glycine 0 CA--C 1.538 1.529 0 N-CA-C 114.611 0.604 . . . . 52.21 114.611 173.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -82.39 35.78 0.59 Allowed 'Trans proline' 0 C--N 1.374 1.906 0 C-N-CA 123.54 2.827 . . . . 60.23 113.557 176.723 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 65.4 m -76.34 152.66 36.29 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.166 0.586 . . . . 65.15 112.182 -177.651 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 87.5 p -63.7 -30.09 71.23 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 123.252 0.621 . . . . 73.4 110.462 168.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -55.37 -40.04 70.83 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 124.417 1.087 . . . . 63.2 110.977 170.568 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.55 HG23 ' HB3' ' A' ' 28' ' ' GLU . 32.2 m -75.76 -47.32 26.41 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 114.827 -1.079 . . . . 51.52 109.414 -174.248 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 21.1 m-85 -63.71 -30.43 71.53 Favored 'General case' 0 CA--C 1.551 0.997 0 CA-C-N 114.802 -1.09 . . . . 74.52 112.042 178.254 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.79 -42.57 77.16 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.421 0.688 . . . . 71.24 111.341 175.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -61.28 -55.75 28.38 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 122.791 0.436 . . . . 62.43 110.522 174.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.402 ' HB2' HG11 ' A' ' 53' ' ' VAL . 72.8 mt -61.47 -25.65 67.38 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.486 1.115 . . . . 60.43 113.107 -178.173 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.47 -56.13 18.6 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-O 121.153 0.502 . . . . 55.02 111.231 173.085 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -71.66 -30.63 65.94 Favored 'General case' 0 N--CA 1.482 1.174 0 CA-C-N 116.014 -0.539 . . . . 62.41 112.213 -178.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 8.5 tmtm? -73.91 -53.78 9.4 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.988 0.915 . . . . 75.12 110.659 -176.36 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.418 HD22 ' HA ' ' A' ' 21' ' ' ASP . 88.3 mt -86.73 3.06 46.48 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.262 0.625 . . . . 71.53 112.67 -175.667 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.0 t70 60.5 34.21 20.44 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-O 122.372 1.082 . . . . 61.34 110.666 -175.336 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 47.5 mmtm -107.17 -177.86 3.48 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 115.0 -1.0 . . . . 64.12 111.291 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.454 ' HB2' ' HG3' ' A' ' 52' ' ' GLN . 2.2 m120 -105.37 148.28 36.03 Favored Pre-proline 0 CA--C 1.554 1.131 0 N-CA-C 108.84 -0.8 . . . . 72.32 108.84 172.445 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_exo -53.4 -34.95 73.53 Favored 'Trans proline' 0 C--N 1.384 2.441 0 C-N-CA 122.746 2.297 . . . . 74.43 114.329 178.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 23.8 m120 -68.06 -44.72 75.69 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.654 0.382 . . . . 72.22 111.267 174.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.454 ' HG3' ' HB2' ' A' ' 49' ' ' ASN . 96.5 mt-30 -57.75 -45.4 85.93 Favored 'General case' 0 N--CA 1.494 1.73 0 C-N-CA 123.037 0.535 . . . . 54.22 111.393 176.25 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.402 HG11 ' HB2' ' A' ' 42' ' ' LEU . 87.9 t -63.83 -50.88 75.7 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.896 0 C-N-CA 123.717 0.807 . . . . 71.12 111.628 -179.856 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.447 ' O ' ' HG3' ' A' ' 58' ' ' GLN . 90.2 p -60.78 -43.41 98.13 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.185 0.594 . . . . 54.13 112.21 -176.313 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.437 ' O ' ' HG2' ' A' ' 59' ' ' GLN . 44.0 mt-10 -67.05 -43.66 82.16 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.148 0.579 . . . . 71.44 111.871 178.427 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 22.1 tpt180 -62.9 -39.95 96.1 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 123.137 0.575 . . . . 74.23 111.396 177.434 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.667 ' HE1' ' HG ' ' A' ' 29' ' ' CYS . 3.5 t80 -52.37 -48.3 65.67 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.547 1.139 . . . . 74.42 111.045 172.365 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.447 ' HG3' ' O ' ' A' ' 54' ' ' SER . 49.6 mt-30 -66.74 -34.51 78.0 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 115.851 -0.613 . . . . 74.12 111.532 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.437 ' HG2' ' O ' ' A' ' 55' ' ' GLU . 11.7 mm-40 -69.96 -33.36 71.99 Favored 'General case' 0 N--CA 1.486 1.345 0 CA-C-O 120.893 0.378 . . . . 72.14 110.579 177.905 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.458 HD23 HD12 ' A' ' 63' ' ' LEU . 32.8 mt -62.38 -41.91 99.0 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.059 0.944 . . . . 74.21 111.331 170.823 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 34.5 mmt -60.53 -40.24 90.77 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 123.388 0.675 . . . . 74.4 111.057 175.02 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.76 -27.94 68.67 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.744 0.818 . . . . 73.55 112.556 176.029 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.458 HD12 HD23 ' A' ' 60' ' ' LEU . 97.0 mt -68.37 -36.63 79.48 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 122.793 0.437 . . . . 75.53 111.789 176.044 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -64.67 -37.78 88.75 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 122.998 0.519 . . . . 75.01 111.46 175.383 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 53.5 mt-10 -70.03 -48.67 57.01 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.019 0.528 . . . . 71.41 110.77 175.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 53.2 tttm 71.7 -53.53 0.68 Allowed 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 126.651 1.981 . . . . 51.32 113.246 179.071 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 44.3 t -52.45 -36.32 54.36 Favored 'General case' 0 N--CA 1.499 1.98 0 C-N-CA 124.019 0.928 . . . . 53.51 112.88 176.049 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 56.8 tptt -68.13 -56.59 8.25 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 123.176 0.59 . . . . 72.13 110.961 175.507 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 42.0 t 53.91 75.37 0.28 Allowed 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 124.383 1.073 . . . . 60.01 111.797 -178.759 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 48.0 ttp180 . . . . . 0 CA--C 1.572 1.805 0 C-N-CA 125.042 1.337 . . . . 63.15 111.68 -175.358 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 40.1 t . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.898 0.38 . . . . 64.53 110.862 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 86.2 m-70 -126.82 136.34 52.24 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.722 0.809 . . . . 70.42 110.216 178.281 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 60.1 mtt -90.66 -178.55 5.31 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.065 0.546 . . . . 74.05 110.011 168.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.433 ' NZ ' ' HB3' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -79.68 87.11 5.22 Favored 'General case' 0 CA--C 1.555 1.158 0 N-CA-C 107.872 -1.158 . . . . 72.12 107.872 172.632 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 -137.95 99.36 3.88 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 123.767 0.827 . . . . 75.23 110.074 178.256 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 18.5 m -93.83 106.4 18.0 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.079 0 CA-C-O 121.428 0.632 . . . . 75.14 110.427 176.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.669 ' HB ' ' HA ' ' A' ' 64' ' ' PHE . 2.9 mp -89.79 3.01 6.55 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.65 0 CA-C-O 121.64 0.733 . . . . 61.22 109.458 175.945 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -65.88 91.64 0.15 Allowed 'General case' 0 CA--C 1.558 1.28 0 C-N-CA 124.138 0.975 . . . . 75.23 110.427 172.159 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.6 ttmp? -127.93 -69.03 0.75 Allowed 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.635 0.774 . . . . 61.24 110.838 -178.241 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -88.59 96.61 10.71 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.364 0.666 . . . . 74.13 110.899 -173.627 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 171.0 106.87 0.19 Allowed Glycine 0 CA--C 1.53 0.982 0 CA-C-N 115.784 -0.643 . . . . 72.41 112.214 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -78.95 143.71 35.52 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.356 0.662 . . . . 73.44 111.675 -178.595 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.515 HD12 ' HB2' ' A' ' 17' ' ' TRP . 13.6 pt -132.18 125.6 54.63 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.161 0 C-N-CA 124.262 1.025 . . . . 65.33 110.68 179.584 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 41.8 mm -81.21 -41.67 19.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 123.386 0.674 . . . . 64.22 110.399 178.173 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 33.8 mt -73.02 144.62 12.66 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 CA-C-N 114.765 -1.107 . . . . 61.24 110.152 178.834 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.0 mp -66.81 89.21 0.15 Allowed 'General case' 0 CA--C 1.559 1.295 0 C-N-CA 123.614 0.766 . . . . 75.54 110.967 -179.639 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' TRP . . . . . 0.515 ' HB2' HD12 ' A' ' 13' ' ' ILE . 79.3 m95 -118.38 109.07 15.83 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.98 0.912 . . . . 74.41 109.851 177.201 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 19.4 p -108.48 168.29 9.43 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 122.245 -0.284 . . . . 74.41 110.684 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 24.1 ptt-85 -53.85 -21.78 8.38 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 124.401 1.081 . . . . 65.33 112.912 176.252 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.402 ' O ' HG23 ' A' ' 24' ' ' VAL . 22.8 m-80 -74.14 -49.6 23.04 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.359 0.664 . . . . 74.2 110.329 175.289 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -60.29 -58.95 6.34 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.895 0.878 . . . . 71.02 111.768 -178.653 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.612 ' HB2' HD21 ' A' ' 60' ' ' LEU . 2.1 p30 -66.2 -31.67 72.63 Favored 'General case' 0 CA--C 1.558 1.282 0 N-CA-C 113.268 0.84 . . . . 74.42 113.268 -172.492 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 34.9 ttt180 -60.23 -44.06 95.52 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 123.487 0.715 . . . . 73.31 111.64 173.615 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.402 HG23 ' O ' ' A' ' 20' ' ' ASN . 80.3 t -66.52 -37.61 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 C-N-CA 123.225 0.61 . . . . 44.44 111.201 177.869 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 78.1 mt -58.13 -56.2 17.45 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 122.749 0.42 . . . . 71.25 111.151 176.325 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.584 ' HG ' HD13 ' A' ' 60' ' ' LEU . 78.5 mt -57.99 -37.32 74.02 Favored 'General case' 0 N--CA 1.484 1.231 0 N-CA-C 112.322 0.49 . . . . 55.31 112.322 179.148 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 46.4 tp -63.65 -51.56 64.63 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.591 0.756 . . . . 74.34 112.447 -178.703 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -77.97 -22.24 49.72 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 112.679 0.622 . . . . 74.53 112.679 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 80.3 m -75.35 -41.66 56.05 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 112.215 0.45 . . . . 74.32 112.215 177.678 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -70.14 -29.25 66.13 Favored 'General case' 0 N--CA 1.491 1.625 0 C-N-CA 122.711 0.404 . . . . 60.42 111.204 175.404 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -73.98 -66.9 0.66 Allowed 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 124.045 0.938 . . . . 63.21 111.212 177.728 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 60.7 mtt-85 -80.41 -56.85 3.9 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.193 0.997 . . . . 73.24 111.328 -171.683 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 129.71 154.78 8.23 Favored Glycine 0 CA--C 1.538 1.523 0 CA-C-O 119.356 -0.691 . . . . 72.32 112.499 -177.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_exo -65.46 94.3 0.25 Allowed 'Trans proline' 0 C--N 1.377 2.042 0 C-N-CA 123.27 2.647 . . . . 74.43 112.684 176.73 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 67.3 m -142.24 155.64 45.26 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 124.07 0.948 . . . . 74.13 110.587 -178.594 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 91.2 p -59.92 -40.31 88.43 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 123.319 0.647 . . . . 63.42 112.411 -176.909 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 38.6 mtmm -68.37 -24.41 64.79 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.041 0.537 . . . . 73.14 112.337 176.801 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 68.5 m -78.19 -43.05 29.59 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 109.225 -0.657 . . . . 64.32 109.225 -179.544 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -72.07 -29.19 63.89 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 115.267 -0.879 . . . . 72.43 111.563 176.696 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.15 -34.72 61.65 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.518 0.727 . . . . 74.02 111.329 174.424 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 86.2 t80 -63.91 -48.53 76.25 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 122.995 0.518 . . . . 71.23 110.392 172.552 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.445 ' HB2' HG11 ' A' ' 53' ' ' VAL . 81.7 mt -66.36 -27.28 67.76 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.26 1.024 . . . . 70.52 112.109 176.255 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.83 -42.32 86.02 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.074 0.55 . . . . 54.23 111.207 172.36 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.42 -34.88 68.17 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.157 0.583 . . . . 61.31 111.478 175.702 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 58.8 tptt -67.21 -40.25 86.41 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.843 1.257 . . . . 71.2 111.358 -179.516 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 46.8 mt -109.26 12.23 24.96 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.807 0.843 . . . . 73.12 112.263 -175.518 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.7 p30 49.49 22.77 0.78 Allowed 'General case' 0 N--CA 1.51 2.527 0 C-N-CA 126.327 1.851 . . . . 74.34 114.75 -175.624 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 44.9 mmtm -99.67 -172.17 2.2 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.838 0.855 . . . . 63.31 111.319 179.388 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 -98.71 145.57 30.15 Favored Pre-proline 0 N--CA 1.489 1.512 0 C-N-CA 123.495 0.718 . . . . 73.25 110.52 176.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_exo -57.76 -32.73 95.54 Favored 'Trans proline' 0 C--N 1.387 2.558 0 C-N-CA 123.293 2.662 . . . . 54.55 113.839 -178.701 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -61.46 -48.93 78.89 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.998 0.919 . . . . 65.5 111.25 174.357 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -63.3 -41.35 98.95 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.822 0.849 . . . . 75.42 111.396 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.445 HG11 ' HB2' ' A' ' 42' ' ' LEU . 93.9 t -65.49 -42.99 94.51 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 C-N-CA 123.878 0.871 . . . . 35.11 111.441 177.787 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 37.8 t -64.2 -44.14 92.88 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.69 0.796 . . . . 51.33 111.904 -178.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.409 ' O ' ' HG3' ' A' ' 59' ' ' GLN . 47.4 mt-10 -65.97 -42.7 89.58 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.229 0.612 . . . . 62.24 111.327 174.431 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.433 ' HE ' ' HB3' ' A' ' 22' ' ' ASP . 32.2 tpt180 -60.86 -41.76 96.53 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.284 0.633 . . . . 72.03 111.414 -179.794 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -53.08 -48.27 67.88 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 124.247 1.019 . . . . 64.35 111.385 173.062 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -75.17 -24.67 57.92 Favored 'General case' 0 CA--C 1.555 1.145 0 CA-C-N 115.168 -0.923 . . . . 72.31 112.315 -178.169 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' A' ' 55' ' ' GLU . 98.0 mt-30 -68.36 -45.03 73.9 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 109.448 -0.575 . . . . 70.43 109.448 171.579 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.612 HD21 ' HB2' ' A' ' 22' ' ' ASP . 31.6 mt -56.01 -56.37 21.58 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.381 1.072 . . . . 72.44 111.75 175.464 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 17.2 mmt -65.62 -29.25 69.81 Favored 'General case' 0 N--CA 1.481 1.095 0 N-CA-C 112.696 0.628 . . . . 54.14 112.696 -178.102 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -76.58 -43.6 38.09 Favored 'General case' 0 N--CA 1.484 1.232 0 N-CA-C 112.358 0.503 . . . . 64.21 112.358 177.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 84.3 mt -75.86 -42.62 48.85 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 123.192 0.597 . . . . 65.25 111.67 -178.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.669 ' HA ' ' HB ' ' A' ' 7' ' ' ILE . 18.6 m-85 -64.44 -22.28 66.91 Favored 'General case' 0 N--CA 1.493 1.697 0 C-N-CA 123.462 0.705 . . . . 52.14 111.722 173.702 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -73.6 -62.64 1.42 Allowed 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 108.832 -0.803 . . . . 74.11 108.832 169.284 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -161.15 121.87 2.79 Favored 'General case' 0 N--CA 1.493 1.712 0 C-N-CA 125.837 1.655 . . . . 70.13 108.687 177.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 65.0 m -62.39 116.49 5.11 Favored 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 112.626 0.602 . . . . 72.13 112.626 179.51 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 53.1 tttp -77.8 118.93 20.62 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 123.597 0.759 . . . . 74.42 109.424 173.829 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 46.7 t -78.98 66.2 4.36 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.544 0.738 . . . . 74.32 112.425 -173.181 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 6.5 tpm_? . . . . . 0 C--O 1.256 1.397 0 C-N-CA 124.511 1.124 . . . . 74.22 110.763 175.248 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 41.1 t . . . . . 0 N--CA 1.497 1.892 0 CA-C-O 120.586 0.231 . . . . 64.05 111.387 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 50.1 m80 -124.41 98.09 5.59 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.577 0.751 . . . . 72.03 109.865 177.008 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 84.2 mtp -122.73 108.12 12.7 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.359 0.664 . . . . 44.41 111.595 -175.1 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 54.9 pttt -106.17 111.16 23.66 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.548 0.739 . . . . 75.54 109.349 169.013 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -65.51 120.13 12.31 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 122.789 0.436 . . . . 63.43 111.478 -177.029 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.4 p -63.85 97.22 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.562 1.421 0 C-N-CA 123.576 0.75 . . . . 32.03 111.057 179.635 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 31.2 pt -67.81 92.26 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.559 1.31 0 CA-C-O 122.353 1.073 . . . . 71.12 111.655 -177.698 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -78.24 113.89 16.62 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 115.201 -0.909 . . . . 73.33 110.878 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -84.8 151.89 24.03 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 123.106 0.563 . . . . 73.32 110.113 171.362 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 34.1 ttpt 64.99 102.2 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 124.702 1.201 . . . . 55.33 112.098 -176.153 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -85.2 126.57 7.77 Favored Glycine 0 C--N 1.342 0.915 0 N-CA-C 110.333 -1.107 . . . . 50.43 110.333 166.605 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -61.62 143.51 55.96 Favored 'General case' 0 CA--C 1.562 1.43 0 CA-C-N 117.528 0.664 . . . . 72.52 112.701 -175.747 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 59.5 mt -79.89 152.57 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 C-N-CA 123.946 0.898 . . . . 73.22 109.772 178.468 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 71.8 mt 75.97 -61.59 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 C-N-CA 125.192 1.397 . . . . 75.11 110.532 -171.055 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.45 HD12 ' HE1' ' A' ' 17' ' ' TRP . 10.8 pt -114.23 114.32 46.34 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 C-N-CA 124.521 1.129 . . . . 71.53 111.191 -178.422 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 37.8 tp -81.67 78.18 8.43 Favored 'General case' 0 CA--C 1.552 1.02 0 CA-C-O 121.559 0.695 . . . . 71.34 111.094 -178.352 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' TRP . . . . . 0.45 ' HE1' HD12 ' A' ' 15' ' ' ILE . 90.8 m95 -65.87 119.99 12.27 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-N 115.326 -0.852 . . . . 75.35 110.545 165.219 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 44.5 p -116.89 169.82 9.09 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 123.092 0.557 . . . . 64.21 110.222 176.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 16.7 ptt180 -57.81 -20.84 38.58 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 112.32 0.489 . . . . 72.24 112.32 177.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.434 ' O ' HG23 ' A' ' 24' ' ' VAL . 27.2 m-80 -70.19 -50.63 38.22 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.227 0.611 . . . . 73.21 110.391 175.453 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.459 ' HA ' HD22 ' A' ' 46' ' ' LEU . 16.5 m-20 -65.12 -54.8 24.36 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.239 0.616 . . . . 62.52 111.068 -179.712 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.603 ' HB3' HD21 ' A' ' 60' ' ' LEU . 1.2 m-20 -54.76 -39.38 68.27 Favored 'General case' 0 CA--C 1.559 1.295 0 C-N-CA 124.915 1.286 . . . . 72.4 113.223 -179.384 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 17.5 tpt180 -65.2 -44.81 87.14 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 122.512 0.325 . . . . 74.42 111.484 177.408 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 20' ' ' ASN . 57.7 t -67.69 -31.02 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 C-N-CA 122.787 0.435 . . . . 73.51 112.086 -176.846 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 87.9 mt -55.02 -56.41 11.14 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.417 0 CA-C-O 120.826 0.346 . . . . 51.02 110.432 169.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.41 HD11 ' HB3' ' A' ' 60' ' ' LEU . 68.2 mt -65.22 -28.87 69.67 Favored 'General case' 0 CA--C 1.556 1.209 0 C-N-CA 123.314 0.645 . . . . 75.3 112.198 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 61.1 tp -69.11 -48.81 61.55 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.432 0.693 . . . . 63.51 111.518 177.165 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.434 ' HA ' ' HB3' ' A' ' 31' ' ' LYS . 11.2 mm-40 -76.81 -19.19 57.84 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.115 0.566 . . . . 73.43 112.436 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 98.6 m -74.62 -33.25 62.53 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 112.104 0.409 . . . . 63.34 112.104 174.303 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.2 pt20 -85.37 -24.04 27.74 Favored 'General case' 0 N--CA 1.493 1.712 0 C-N-CA 122.481 0.313 . . . . 73.13 111.413 172.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.434 ' HB3' ' HA ' ' A' ' 28' ' ' GLU . 60.6 tptt -84.26 -71.57 0.51 Allowed 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.721 0.808 . . . . 75.23 110.953 179.196 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.465 ' HD3' HG23 ' A' ' 38' ' ' THR . 39.9 ttt180 -79.11 -42.52 26.1 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 124.489 1.115 . . . . 73.43 111.824 -176.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 125.62 147.66 7.02 Favored Glycine 0 CA--C 1.54 1.6 0 CA-C-O 119.317 -0.713 . . . . 42.3 112.849 179.388 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -73.75 107.48 2.42 Favored 'Trans proline' 0 C--N 1.378 2.085 0 C-N-CA 123.114 2.543 . . . . 75.01 112.118 178.696 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 48.5 t -156.1 151.24 26.5 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.419 0.688 . . . . 54.2 110.814 -178.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 64.7 p -64.13 -27.79 69.33 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 122.928 0.491 . . . . 75.43 111.32 175.167 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 40.4 tttm -72.83 -21.66 60.92 Favored 'General case' 0 CA--C 1.561 1.376 0 C-N-CA 123.986 0.914 . . . . 73.14 110.665 175.569 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.465 HG23 ' HD3' ' A' ' 32' ' ' ARG . 81.5 m -86.96 -34.37 19.34 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 124.318 1.047 . . . . 74.44 110.015 173.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.444 ' HD1' HD12 ' A' ' 42' ' ' LEU . 21.5 m-85 -71.38 -28.34 63.97 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.434 0.694 . . . . 75.12 111.836 -179.868 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.482 ' HA ' ' HG3' ' A' ' 50' ' ' PRO . . . -67.98 -32.34 72.69 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.252 0.621 . . . . 63.01 111.44 170.477 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 50.2 t80 -76.05 -38.47 57.1 Favored 'General case' 0 CA--C 1.558 1.279 0 C-N-CA 123.596 0.758 . . . . 63.13 111.291 175.456 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.492 HD23 ' HD2' ' A' ' 45' ' ' LYS . 68.7 mt -66.31 -29.34 69.53 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.969 0.908 . . . . 75.42 111.263 173.335 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.57 -45.07 88.62 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 123.268 0.627 . . . . 63.11 111.203 171.343 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.07 -53.58 56.09 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 123.661 0.784 . . . . 73.22 112.585 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.583 ' HG3' ' HG ' ' A' ' 46' ' ' LEU . 0.2 OUTLIER -71.0 -40.23 71.94 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 112.889 0.7 . . . . 54.15 112.889 -175.844 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.583 ' HG ' ' HG3' ' A' ' 45' ' ' LYS . 81.6 mt -92.87 14.15 18.32 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 112.964 0.727 . . . . 74.43 112.964 -174.56 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.1 p30 51.2 22.45 1.34 Allowed 'General case' 0 N--CA 1.503 2.206 0 C-N-CA 125.951 1.7 . . . . 41.3 114.562 -176.387 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.409 ' HG2' ' O ' ' A' ' 46' ' ' LEU . 47.6 mmtm -101.72 -166.34 1.29 Allowed 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.948 0.899 . . . . 73.42 111.229 -179.587 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -127.45 146.62 59.01 Favored Pre-proline 0 CA--C 1.564 1.481 0 C-N-CA 123.259 0.624 . . . . 75.12 110.248 -179.319 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.482 ' HG3' ' HA ' ' A' ' 40' ' ' ALA . 59.3 Cg_exo -52.45 -38.81 74.85 Favored 'Trans proline' 0 C--N 1.389 2.668 0 C-N-CA 124.037 3.158 . . . . 74.31 115.71 -170.901 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 46.6 t-20 -59.28 -44.83 92.44 Favored 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 123.306 0.643 . . . . 62.04 110.713 177.592 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.436 ' NE2' HG21 ' A' ' 15' ' ' ILE . 36.9 mt-30 -67.0 -43.07 83.86 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.938 0.895 . . . . 71.13 110.777 -177.297 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.441 HG22 ' HH2' ' A' ' 17' ' ' TRP . 52.9 t -65.19 -45.81 92.77 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 CA-C-N 115.152 -0.931 . . . . 75.4 111.761 -178.879 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 80.8 p -64.3 -40.4 95.88 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.516 0.727 . . . . 70.12 111.724 -177.358 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -63.6 -49.59 72.74 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 116.043 -0.526 . . . . 62.2 111.176 172.616 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 10.9 tpt85 -60.83 -37.53 82.34 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 115.858 -0.61 . . . . 74.23 111.466 -174.034 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 29.1 t80 -53.13 -53.65 47.37 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 124.529 1.132 . . . . 70.32 112.881 176.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -73.82 -24.58 59.81 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 122.906 0.482 . . . . 62.32 111.968 -175.45 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 82.7 mm-40 -69.97 -42.71 72.78 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.121 0.568 . . . . 64.32 109.795 170.401 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.603 HD21 ' HB3' ' A' ' 22' ' ' ASP . 17.7 mt -61.71 -51.99 66.1 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.736 1.214 . . . . 53.12 112.542 -178.232 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 5.7 mmt -62.08 -29.49 70.34 Favored 'General case' 0 N--CA 1.485 1.32 0 N-CA-C 112.244 0.461 . . . . 73.44 112.244 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.7 ttmp? -74.92 -46.92 32.54 Favored 'General case' 0 CA--C 1.56 1.338 0 C-N-CA 123.865 0.866 . . . . 75.23 111.921 177.776 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 92.6 mt -76.68 -46.62 24.92 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.448 0.699 . . . . 65.23 112.721 -177.098 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -62.53 -22.61 66.43 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.519 0.728 . . . . 73.42 111.57 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -57.99 -43.77 86.77 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 123.618 0.767 . . . . 73.23 111.447 172.581 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -166.58 -57.65 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 123.386 0.674 . . . . 73.11 111.338 -177.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 22.0 t 60.21 -137.12 0.68 Allowed 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 124.237 1.015 . . . . 62.44 110.107 -172.156 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 67.3 mttm 75.8 -31.07 0.19 Allowed 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 114.84 1.422 . . . . 74.45 114.84 168.686 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 17.4 p -81.92 67.01 7.75 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.883 0.873 . . . . 62.11 112.457 -171.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 48.9 ttt85 . . . . . 0 CA--C 1.561 1.398 0 C-N-CA 124.677 1.191 . . . . 74.34 109.45 176.764 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.2 m . . . . . 0 N--CA 1.491 1.592 0 CA-C-O 120.264 0.078 . . . . 73.43 111.044 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 90.6 m-70 -70.53 109.78 5.03 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 122.779 0.432 . . . . 75.43 110.592 177.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 87.8 mtp -68.01 109.32 3.42 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.598 0.759 . . . . 60.14 111.345 179.485 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -92.45 167.75 11.75 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 123.247 0.619 . . . . 63.42 111.003 176.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -114.84 139.78 49.48 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.498 0.719 . . . . 71.22 109.778 170.126 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 69.4 t -67.6 113.44 3.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 C-N-CA 122.983 0.513 . . . . 64.32 109.902 177.28 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 16.2 tt -71.94 81.58 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.567 1.608 0 CA-C-O 122.631 1.205 . . . . 75.41 111.888 -176.331 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.62 83.17 1.88 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.794 1.238 . . . . 73.3 109.322 176.01 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 57.9 pttt -64.58 -37.47 87.68 Favored 'General case' 0 N--CA 1.484 1.253 0 CA-C-N 114.923 -1.035 . . . . 63.43 111.649 176.384 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -134.79 168.71 18.54 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.795 0.838 . . . . 73.55 111.432 -179.325 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 175.79 149.0 7.17 Favored Glycine 0 CA--C 1.529 0.931 0 CA-C-N 115.448 -0.796 . . . . 75.23 111.301 179.425 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -81.86 69.98 8.67 Favored 'General case' 0 CA--C 1.555 1.158 0 CA-C-O 121.695 0.76 . . . . 65.13 111.253 -178.209 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.502 HG22 ' H ' ' A' ' 15' ' ' ILE . 3.8 mp -127.08 114.68 38.16 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 N-CA-C 107.58 -1.267 . . . . 65.0 107.58 171.577 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 2.2 pp -84.7 13.23 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 C-N-CA 123.552 0.741 . . . . 72.2 112.831 -177.735 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.502 ' H ' HG22 ' A' ' 13' ' ' ILE . 27.1 mt -109.05 147.49 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 124.994 1.318 . . . . 61.31 109.242 177.63 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 60.4 tp -63.55 119.59 10.1 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 122.898 0.479 . . . . 61.04 110.087 171.161 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 86.4 m95 -147.79 138.3 23.1 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 124.41 1.084 . . . . 74.33 110.547 176.489 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 25.1 p -119.98 159.1 25.39 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.93 0.892 . . . . 61.43 110.259 177.224 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 8.7 ptp85 -64.29 -20.75 66.29 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 123.704 0.802 . . . . 64.44 112.205 174.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -67.7 -44.88 76.69 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.933 0.893 . . . . 73.54 110.312 173.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -59.48 -44.95 92.92 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 123.495 0.718 . . . . 74.11 111.772 177.569 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.41 ' HB3' HD21 ' A' ' 60' ' ' LEU . 61.4 m-20 -54.33 -44.13 71.81 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 124.859 1.264 . . . . 71.42 112.66 179.69 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 61.2 ttp180 -59.62 -43.68 93.7 Favored 'General case' 0 CA--C 1.556 1.184 0 CA-C-N 115.823 -0.626 . . . . 74.34 111.563 177.044 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.6 t -69.28 -38.95 78.45 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 C-N-CA 123.582 0.753 . . . . 73.12 111.534 -177.687 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 90.2 mt -63.72 -52.24 59.78 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 C-N-CA 122.819 0.447 . . . . 53.4 111.012 177.697 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.407 ' HG ' HD13 ' A' ' 60' ' ' LEU . 97.6 mt -58.43 -34.92 71.33 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.129 0.572 . . . . 65.53 111.813 175.437 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 35.2 tp -63.48 -55.28 25.37 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.183 0.593 . . . . 72.14 111.121 178.217 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 54.6 mm-40 -72.43 -23.77 61.12 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 112.874 0.694 . . . . 64.55 112.874 -176.698 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 91.3 m -69.71 -30.01 67.54 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 122.719 0.408 . . . . 53.13 111.238 175.391 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -86.69 -33.31 20.09 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 123.601 0.76 . . . . 75.34 111.8 174.707 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 50.9 mtpt -75.16 -74.9 0.19 Allowed 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 123.493 0.717 . . . . 60.23 111.651 178.524 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 27.2 mtp180 -79.91 -36.93 35.7 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 124.175 0.99 . . . . 63.31 110.353 -172.462 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 122.07 160.4 10.95 Favored Glycine 0 CA--C 1.538 1.497 0 CA-C-N 115.363 -0.835 . . . . 52.44 111.967 -176.425 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -77.64 38.24 0.66 Allowed 'Trans proline' 0 CA--C 1.563 1.937 0 C-N-CA 123.568 2.845 . . . . 53.2 113.593 176.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 34.8 t -75.7 154.24 36.58 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.709 0.804 . . . . 62.44 111.788 179.055 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 98.3 p -61.33 -34.53 75.41 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.847 0.859 . . . . 70.3 111.877 178.092 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt -74.46 -19.51 60.36 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.256 0.622 . . . . 55.32 112.015 177.508 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 51.6 m -78.17 -33.91 49.91 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 109.183 -0.673 . . . . 65.44 109.183 173.426 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -70.64 -30.96 67.72 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.429 0.692 . . . . 72.22 111.245 173.062 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.96 -36.12 77.53 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.339 0.656 . . . . 55.1 111.566 171.163 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 82.4 t80 -63.57 -48.68 76.46 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 123.303 0.641 . . . . 73.35 110.704 171.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.453 ' HB2' HG11 ' A' ' 53' ' ' VAL . 59.9 mt -66.77 -23.05 66.03 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 124.603 1.161 . . . . 71.24 112.303 178.218 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.87 -53.52 49.18 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.102 0.561 . . . . 73.33 111.172 171.658 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -71.54 -28.21 63.72 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.09 0.556 . . . . 64.1 112.436 179.406 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.408 ' HE3' ' HA ' ' A' ' 45' ' ' LYS . 0.2 OUTLIER -72.8 -47.32 47.52 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.508 0.723 . . . . 72.33 111.247 178.686 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 52.1 mt -101.22 5.22 42.48 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.449 0.7 . . . . 71.24 112.444 -172.14 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 61.65 29.67 18.25 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 124.304 1.042 . . . . 42.31 112.217 -177.008 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.0 mmtm -104.0 -165.81 1.19 Allowed 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 124.565 1.146 . . . . 73.41 110.434 178.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 65.0 m-20 -119.96 145.59 40.09 Favored Pre-proline 0 N--CA 1.489 1.49 0 CA-C-O 118.36 -0.829 . . . . 71.34 110.43 178.104 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -50.78 -46.03 32.44 Favored 'Trans proline' 0 C--N 1.385 2.487 0 C-N-CA 123.638 2.892 . . . . 75.02 114.801 -174.395 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -66.31 -41.59 89.47 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.643 0.777 . . . . 55.25 111.13 179.143 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -67.22 -34.7 78.03 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.725 0.81 . . . . 72.55 111.995 -178.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.453 HG11 ' HB2' ' A' ' 42' ' ' LEU . 60.6 t -71.77 -38.9 67.52 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 C-N-CA 123.016 0.526 . . . . 74.53 110.583 174.041 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.2 t -59.91 -44.46 94.26 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.954 0.901 . . . . 35.31 111.093 177.853 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -63.65 -43.9 95.39 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.06 0.544 . . . . 64.4 110.986 173.709 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 23.5 tpt180 -63.68 -35.22 79.82 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.629 0.772 . . . . 55.1 112.666 -176.195 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -54.71 -47.47 73.69 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.601 0.761 . . . . 74.0 110.873 171.197 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -73.95 -24.29 59.62 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 115.191 -0.913 . . . . 74.45 112.04 -178.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.433 ' O ' ' HG ' ' A' ' 63' ' ' LEU . 17.4 mm-40 -70.19 -38.04 75.24 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.111 0.564 . . . . 73.31 110.173 172.166 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.41 HD21 ' HB3' ' A' ' 22' ' ' ASP . 31.7 mt -60.87 -53.55 56.0 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.179 0.992 . . . . 72.35 111.577 175.03 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 90.1 mmm -62.7 -31.28 72.16 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 122.954 0.502 . . . . 63.33 111.651 178.422 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -65.24 -33.4 75.91 Favored 'General case' 0 CA--C 1.558 1.283 0 C-N-CA 124.238 1.015 . . . . 63.51 111.541 174.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 59' ' ' GLN . 94.6 mt -73.83 -34.05 64.4 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.215 0.606 . . . . 64.51 111.41 173.799 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -65.8 -33.46 75.92 Favored 'General case' 0 N--CA 1.494 1.773 0 C-N-CA 123.603 0.761 . . . . 71.35 111.395 175.138 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -69.66 -30.46 68.16 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.577 0.751 . . . . 73.43 111.665 174.054 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 45.2 mtmt 74.19 -60.5 0.52 Allowed 'General case' 0 N--CA 1.499 1.984 0 C-N-CA 125.595 1.558 . . . . 73.32 114.2 172.444 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 48.0 t -81.93 114.35 20.47 Favored 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 113.754 1.02 . . . . 64.21 113.754 -169.474 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.32 41.42 2.95 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 124.772 1.229 . . . . 75.41 109.48 168.322 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 49.3 t 77.27 -22.14 0.3 Allowed 'General case' 0 N--CA 1.499 2.002 0 C-N-CA 125.947 1.699 . . . . 73.13 114.061 177.199 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 14.6 mmp_? . . . . . 0 N--CA 1.493 1.676 0 C-N-CA 123.371 0.668 . . . . 74.53 111.37 177.919 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 46.0 t . . . . . 0 N--CA 1.483 1.208 0 N-CA-C 110.466 -0.198 . . . . 75.51 110.466 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 78.9 t60 64.73 146.78 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 125.128 1.371 . . . . 72.22 113.106 178.71 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.414 ' SD ' ' N ' ' A' ' 3' ' ' MET . 3.2 mpp? -71.84 86.04 0.96 Allowed 'General case' 0 N--CA 1.48 1.025 0 CA-C-O 121.24 0.543 . . . . 62.22 109.629 171.222 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.625 ' H ' ' HD3' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -69.68 -175.72 0.92 Allowed 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 124.011 0.925 . . . . 75.34 112.687 -176.883 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 20.1 m120 64.28 29.47 13.72 Favored 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 124.334 1.054 . . . . 75.21 111.377 -172.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 15.8 m -68.9 -30.92 48.53 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.407 0 N-CA-C 112.647 0.61 . . . . 74.24 112.647 178.167 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.506 ' H ' HD12 ' A' ' 7' ' ' ILE . 2.8 mp -81.05 133.18 29.87 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 N-CA-C 109.41 -0.589 . . . . 72.24 109.41 176.772 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -76.75 156.5 32.36 Favored 'General case' 0 N--CA 1.488 1.446 0 CA-C-O 121.516 0.674 . . . . 74.11 111.515 176.248 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.96 29.32 1.62 Allowed 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 124.171 0.988 . . . . 75.42 110.908 -174.059 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 88.3 tttt 69.85 -67.92 0.21 Allowed 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 125.385 1.474 . . . . 64.44 111.694 -175.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -131.51 -178.19 15.33 Favored Glycine 0 N--CA 1.477 1.376 0 C-N-CA 122.987 0.327 . . . . 71.22 112.657 176.248 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -79.4 101.49 8.17 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 122.912 0.485 . . . . 73.23 110.253 177.78 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.521 ' HB ' HH21 ' A' ' 56' ' ' ARG . 18.4 pt -90.93 104.6 15.58 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.354 0 CA-C-O 121.708 0.766 . . . . 45.32 110.954 -179.203 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 47.4 mt -73.18 -23.74 20.21 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 C-N-CA 123.92 0.888 . . . . 72.44 112.425 -172.736 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 69.7 mt -64.48 138.5 22.99 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.35 0 C-N-CA 123.177 0.591 . . . . 70.53 110.486 174.31 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.8 mp -63.94 100.62 0.32 Allowed 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.155 0.582 . . . . 72.03 112.059 -177.087 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' TRP . . . . . 0.464 ' CH2' ' HG3' ' A' ' 48' ' ' LYS . 96.8 m95 -125.03 121.31 33.99 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.58 0.752 . . . . 73.11 110.238 176.722 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 82.1 p -128.75 170.22 13.57 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 123.345 0.658 . . . . 62.41 111.304 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 39.5 ptt180 -52.76 -29.71 28.75 Favored 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 124.807 1.243 . . . . 72.54 113.576 -175.054 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.442 ' O ' HG23 ' A' ' 24' ' ' VAL . 18.3 m120 -77.87 -44.46 27.09 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 123.284 0.634 . . . . 75.31 111.714 177.677 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -59.5 -49.78 76.46 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 122.983 0.513 . . . . 54.12 111.582 -178.398 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.682 ' HB2' HD21 ' A' ' 60' ' ' LEU . 2.9 p30 -68.72 -32.45 72.26 Favored 'General case' 0 CA--C 1.558 1.282 0 CA-C-N 115.519 -0.764 . . . . 71.31 112.243 -177.769 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -63.85 -37.41 87.28 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 123.302 0.641 . . . . 75.44 111.296 173.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 20' ' ' ASN . 86.4 t -69.0 -38.03 77.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 C-N-CA 123.242 0.617 . . . . 73.13 111.298 176.338 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.404 HD11 ' CZ3' ' A' ' 17' ' ' TRP . 81.9 mt -55.96 -57.49 8.15 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 C-N-CA 122.439 0.295 . . . . 73.22 110.243 173.657 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.515 ' HG ' HD13 ' A' ' 60' ' ' LEU . 96.0 mt -60.12 -36.52 77.66 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.638 0.775 . . . . 72.32 112.517 178.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 42.5 tp -59.61 -59.07 6.03 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.138 0.575 . . . . 72.22 110.701 -179.006 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -70.69 -25.54 63.02 Favored 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 123.338 0.655 . . . . 71.33 112.536 -179.552 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 90.4 m -73.66 -36.79 65.41 Favored 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 112.353 0.501 . . . . 61.42 112.353 178.767 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -81.5 -30.71 33.19 Favored 'General case' 0 N--CA 1.492 1.627 0 CA-C-O 121.378 0.609 . . . . 71.22 111.03 176.112 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -72.17 -46.66 55.44 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 125.147 1.379 . . . . 70.44 112.522 178.842 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 53.3 mtp180 -114.78 -25.08 8.39 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 123.91 0.884 . . . . 55.14 112.722 -170.353 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 108.65 129.13 5.87 Favored Glycine 0 N--CA 1.479 1.52 0 CA-C-O 118.915 -0.936 . . . . 41.35 111.879 -173.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -74.2 85.43 1.4 Allowed 'Trans proline' 0 C--N 1.377 2.053 0 C-N-CA 122.618 2.212 . . . . 64.32 112.684 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 18.0 t -141.19 -179.24 5.99 Favored 'General case' 0 N--CA 1.482 1.159 0 CA-C-N 115.42 -0.809 . . . . 75.45 110.496 178.606 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 84.0 p -58.8 -36.44 74.45 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 114.156 1.169 . . . . 74.14 114.156 -169.13 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -70.0 -27.49 64.74 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 123.004 0.522 . . . . 73.0 111.866 -178.47 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 70.4 m -85.66 -43.76 13.16 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.437 0.695 . . . . 63.05 109.987 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -67.84 -29.29 68.39 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.363 0.665 . . . . 75.11 112.051 178.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.19 -39.92 90.03 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 122.918 0.487 . . . . 75.5 111.211 173.211 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 66.8 t80 -65.41 -51.09 62.75 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 116.077 -0.511 . . . . 72.2 110.686 174.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 79.4 mt -59.64 -31.02 69.14 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 124.362 1.065 . . . . 75.35 112.56 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.71 -56.04 14.18 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.344 0.657 . . . . 72.15 111.022 172.678 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.82 -25.8 68.07 Favored 'General case' 0 CA--C 1.56 1.363 0 C-N-CA 123.655 0.782 . . . . 50.01 112.617 178.254 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -76.89 -52.11 10.04 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 124.124 0.97 . . . . 74.22 111.34 -177.155 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.413 ' HB2' ' HG2' ' A' ' 48' ' ' LYS . 51.4 mt -91.19 -2.42 57.51 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 124.082 0.953 . . . . 61.15 111.904 -176.141 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.5 t70 69.25 33.5 3.25 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 125.312 1.445 . . . . 71.41 111.425 -177.821 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.464 ' HG3' ' CH2' ' A' ' 17' ' ' TRP . 67.9 mmtt -105.33 -167.18 1.3 Allowed 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 124.489 1.116 . . . . 74.33 110.749 177.289 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -118.71 149.04 45.63 Favored Pre-proline 0 N--CA 1.489 1.523 0 C-N-CA 123.751 0.82 . . . . 72.4 109.996 171.638 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -51.36 -42.1 56.27 Favored 'Trans proline' 0 C--N 1.387 2.556 0 C-N-CA 123.689 2.926 . . . . 73.22 115.761 -172.136 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -65.27 -39.73 93.0 Favored 'General case' 0 N--CA 1.494 1.733 0 C-N-CA 122.621 0.368 . . . . 74.31 111.437 177.402 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.443 ' O ' ' HD3' ' A' ' 56' ' ' ARG . 79.7 mt-30 -65.79 -31.18 72.01 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.552 0.741 . . . . 72.04 111.234 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 95.7 t -74.89 -46.95 39.28 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.145 0 C-N-CA 123.517 0.727 . . . . 72.12 111.016 175.168 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 35.0 t -64.73 -36.13 83.3 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 124.103 0.961 . . . . 74.35 112.801 -174.438 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -71.94 -39.31 69.5 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 122.671 0.388 . . . . 70.42 111.874 177.509 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.521 HH21 ' HB ' ' A' ' 13' ' ' ILE . 5.7 mpt_? -69.53 -29.39 66.98 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 122.647 0.379 . . . . 64.04 111.026 176.81 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.48 ' HA ' HD12 ' A' ' 60' ' ' LEU . 8.2 t80 -55.37 -43.8 75.46 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.705 0.802 . . . . 75.44 111.019 168.661 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -74.75 -25.13 58.88 Favored 'General case' 0 CA--C 1.558 1.257 0 C-N-CA 123.47 0.708 . . . . 71.41 112.38 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -74.36 -31.85 62.55 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.346 0.593 . . . . 64.05 110.244 171.396 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.682 HD21 ' HB2' ' A' ' 22' ' ' ASP . 38.6 mt -65.83 -34.82 79.03 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.189 0.996 . . . . 72.24 111.482 172.621 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 33.8 mmt -62.72 -31.7 72.67 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.008 0.523 . . . . 74.11 111.564 175.204 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 58.3 mmtt -71.69 -29.92 65.11 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 112.695 0.628 . . . . 70.21 112.695 174.681 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.468 HD12 HD23 ' A' ' 60' ' ' LEU . 51.3 mt -62.46 -40.42 96.59 Favored 'General case' 0 N--CA 1.485 1.322 0 CA-C-O 121.076 0.465 . . . . 75.22 110.501 173.017 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 65.3 m-85 -76.64 -30.25 56.78 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 123.576 0.751 . . . . 74.44 112.36 176.715 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -66.91 -61.55 1.89 Allowed 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.396 0.678 . . . . 64.35 110.858 -176.051 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.451 ' NZ ' ' HB3' ' A' ' 66' ' ' LYS . 4.2 ttpm? -177.03 151.76 0.85 Allowed 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.21 0.604 . . . . 74.44 110.814 -173.384 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.432 ' HA ' HG13 ' A' ' 7' ' ' ILE . 49.0 m -71.52 141.17 50.13 Favored 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 109.969 -0.382 . . . . 70.33 109.969 166.03 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 59.7 mttm 72.76 155.18 0.16 Allowed 'General case' 0 N--CA 1.497 1.923 0 C-N-CA 125.071 1.349 . . . . 71.3 112.331 -177.079 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 44.2 t -67.26 -67.13 0.48 Allowed 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.469 0.708 . . . . 64.45 111.258 -178.366 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.565 1.539 0 C-N-CA 122.991 0.517 . . . . 61.32 111.786 176.649 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 45.6 m . . . . . 0 N--CA 1.495 1.784 0 N-CA-C 111.3 0.111 . . . . 73.24 111.3 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 63.6 m80 62.5 -154.58 0.34 Allowed 'General case' 0 N--CA 1.496 1.827 0 C-N-CA 124.281 1.032 . . . . 61.15 111.342 -178.163 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.508 ' HG3' HH22 ' A' ' 19' ' ' ARG . 38.5 tpp 65.45 88.41 0.11 Allowed 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 124.639 1.176 . . . . 62.13 111.417 177.159 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 35.6 ttmt -154.75 15.15 0.43 Allowed 'General case' 0 CA--C 1.563 1.452 0 C-N-CA 123.827 0.851 . . . . 53.3 110.293 -177.43 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 46.5 t-20 -72.09 92.65 1.34 Allowed 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 123.602 0.761 . . . . 62.23 110.871 -174.154 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 30.1 m -107.59 128.11 63.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 123.593 0.757 . . . . 54.22 110.449 176.597 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.3 mp -93.3 104.44 15.74 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.975 0 C-N-CA 123.548 0.739 . . . . 74.54 109.344 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 56.9 tptt 57.34 86.68 0.07 Allowed 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 124.286 1.034 . . . . 70.22 112.181 177.096 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -68.68 109.55 3.86 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-O 121.304 0.573 . . . . 61.11 111.584 -178.195 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -98.82 95.77 7.42 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.032 0.933 . . . . 70.2 110.013 177.464 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 151.28 76.13 0.02 OUTLIER Glycine 0 CA--C 1.531 1.087 0 CA-C-N 116.343 -0.39 . . . . 64.33 113.454 177.345 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -71.22 103.47 2.82 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 122.898 0.479 . . . . 64.13 110.247 170.809 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 4.3 pt -128.98 116.35 40.33 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.118 0 C-N-CA 124.09 0.956 . . . . 62.42 111.153 -175.654 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 14.9 tt -64.42 -18.45 23.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 C-N-CA 124.464 1.106 . . . . 71.31 112.777 -178.809 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.603 ' H ' HD12 ' A' ' 15' ' ' ILE . 3.6 mp -68.82 -19.98 24.5 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.58 0 C-N-CA 124.364 1.065 . . . . 64.34 111.727 -175.83 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 56.7 tp 63.71 75.03 0.4 Allowed 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 124.631 1.172 . . . . 71.15 111.153 -177.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 82.4 m95 -99.66 113.09 25.32 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 116.001 -0.545 . . . . 75.44 110.802 176.631 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 30.1 p -97.03 155.95 16.57 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 108.324 -0.991 . . . . 65.02 108.324 171.458 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.508 HH22 ' HG3' ' A' ' 3' ' ' MET . 35.3 ptt180 -58.93 -20.31 50.82 Favored 'General case' 0 CA--C 1.558 1.253 0 N-CA-C 112.237 0.458 . . . . 74.12 112.237 176.116 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -71.19 -40.49 71.19 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.969 0.908 . . . . 62.34 111.472 175.024 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.436 ' HA ' HD22 ' A' ' 46' ' ' LEU . 28.9 m-20 -60.54 -61.65 2.43 Favored 'General case' 0 N--CA 1.487 1.378 0 CA-C-O 121.49 0.662 . . . . 75.14 111.281 176.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.576 ' HB2' HD11 ' A' ' 60' ' ' LEU . 1.7 p30 -64.91 -28.67 69.69 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 113.624 0.972 . . . . 63.41 113.624 -174.231 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 28.2 tpt85 -56.21 -38.67 71.34 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 123.03 0.532 . . . . 73.15 111.921 173.238 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 44.0 t -72.9 -31.54 36.4 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 123.332 0.653 . . . . 73.35 111.184 177.059 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 66.0 mt -59.86 -47.19 92.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 C-N-CA 122.527 0.331 . . . . 65.11 110.34 172.743 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.411 HD21 ' HB3' ' A' ' 60' ' ' LEU . 97.4 mt -56.26 -38.96 71.86 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.741 0.817 . . . . 71.14 112.002 175.181 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 57.8 tp -63.81 -59.17 4.88 Favored 'General case' 0 CA--C 1.556 1.175 0 C-N-CA 123.419 0.688 . . . . 72.52 111.739 179.418 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -69.95 -22.15 63.2 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 113.236 0.828 . . . . 63.22 113.236 -175.659 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 65.7 m -69.8 -30.09 67.54 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 122.458 0.303 . . . . 43.33 111.415 173.231 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -84.19 -39.17 19.69 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 122.965 0.506 . . . . 75.32 111.026 174.681 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -61.44 -64.36 0.97 Allowed 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.975 0.91 . . . . 75.54 111.789 178.533 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.49 ' HD2' HG23 ' A' ' 38' ' ' THR . 37.5 mtt-85 -91.07 -52.19 4.96 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.74 0.816 . . . . 70.55 110.976 -174.368 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 131.08 147.1 5.97 Favored Glycine 0 CA--C 1.534 1.249 0 CA-C-N 115.157 -0.929 . . . . 34.11 111.391 -173.013 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -61.06 95.61 0.12 Allowed 'Trans proline' 0 C--N 1.374 1.869 0 C-N-CA 122.894 2.396 . . . . 73.42 112.445 175.524 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 48.3 t -146.95 157.06 43.52 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.985 0.914 . . . . 72.14 110.531 -175.588 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 81.0 p -65.34 -31.94 73.33 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.457 0.703 . . . . 73.53 112.407 -177.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -69.95 -26.66 64.22 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 123.286 0.634 . . . . 72.34 111.726 174.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.49 HG23 ' HD2' ' A' ' 32' ' ' ARG . 97.3 m -77.97 -42.99 31.01 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.759 0.823 . . . . 72.1 109.152 177.161 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -63.86 -28.81 70.1 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 124.028 0.931 . . . . 73.04 111.318 173.285 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.556 ' HA ' ' HG3' ' A' ' 50' ' ' PRO . . . -69.24 -42.35 75.75 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.372 0.669 . . . . 45.14 111.522 175.705 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -59.71 -49.41 77.84 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-O 121.077 0.465 . . . . 70.13 110.51 171.658 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 64.9 mt -63.74 -23.97 67.58 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.537 1.135 . . . . 74.23 112.741 178.495 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.77 -53.95 33.66 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.127 0.571 . . . . 73.12 110.727 172.596 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.27 -35.29 80.58 Favored 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 123.308 0.643 . . . . 25.4 111.635 177.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 58.2 tptt -66.93 -49.7 64.71 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.542 1.137 . . . . 75.42 111.693 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.436 HD22 ' HA ' ' A' ' 21' ' ' ASP . 64.9 mt -96.1 -2.15 47.14 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 113.013 0.746 . . . . 45.43 113.013 -172.715 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 79.88 -1.21 2.1 Favored 'General case' 0 N--CA 1.505 2.312 0 C-N-CA 126.117 1.767 . . . . 74.42 113.398 -178.813 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -88.88 -168.02 2.06 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 112.31 0.485 . . . . 64.01 112.31 -179.532 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -108.43 152.73 42.17 Favored Pre-proline 0 N--CA 1.484 1.248 0 C-N-CA 124.229 1.012 . . . . 75.04 110.126 173.25 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.556 ' HG3' ' HA ' ' A' ' 40' ' ' ALA . 37.4 Cg_exo -57.17 -34.17 97.26 Favored 'Trans proline' 0 C--N 1.39 2.72 0 C-N-CA 123.439 2.759 . . . . 74.21 114.203 -172.37 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.423 ' O ' ' HG3' ' A' ' 55' ' ' GLU . 18.3 m120 -67.78 -39.75 84.06 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.372 0.669 . . . . 65.24 111.497 177.779 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -66.33 -42.22 88.49 Favored 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 123.225 0.61 . . . . 73.24 110.453 177.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 82.0 t -57.58 -41.15 78.47 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 124.314 1.046 . . . . 65.05 111.049 173.754 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.499 ' O ' ' HG3' ' A' ' 58' ' ' GLN . 34.3 t -65.59 -41.25 93.05 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.152 0.581 . . . . 70.12 111.503 178.422 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.423 ' HG3' ' O ' ' A' ' 51' ' ' ASN . 52.0 mt-10 -57.98 -49.55 76.44 Favored 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 123.049 0.54 . . . . 60.42 111.142 176.764 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.4 tpm_? -62.16 -39.1 91.5 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 124.169 0.988 . . . . 71.51 111.818 176.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.415 ' HA ' HD12 ' A' ' 60' ' ' LEU . 16.0 t80 -56.14 -49.77 73.01 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 124.59 1.156 . . . . 71.02 112.252 177.288 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.499 ' HG3' ' O ' ' A' ' 54' ' ' SER . 62.3 mt-30 -68.59 -25.83 65.07 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.479 0.711 . . . . 73.11 111.439 -176.391 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 71.2 mt-30 -71.31 -47.73 54.96 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 115.427 -0.806 . . . . 71.24 109.668 171.791 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.576 HD11 ' HB2' ' A' ' 22' ' ' ASP . 58.2 mt -52.93 -46.65 68.2 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 124.497 1.119 . . . . 55.21 112.603 178.34 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 33.9 mmt -56.43 -48.48 76.91 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.102 0.561 . . . . 75.03 111.822 -179.155 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 85.4 tttt -75.55 -35.6 60.63 Favored 'General case' 0 CA--C 1.559 1.312 0 N-CA-C 112.783 0.66 . . . . 73.41 112.783 -176.276 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 97.1 mt -73.07 -38.18 66.54 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 123.258 0.623 . . . . 44.43 111.554 179.322 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -72.19 -36.43 69.22 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.466 0.706 . . . . 75.32 110.538 179.058 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -69.85 -37.12 76.04 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.04 0.936 . . . . 64.5 111.308 173.323 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 84.3 tttt 74.29 -29.06 0.19 Allowed 'General case' 0 CA--C 1.566 1.595 0 C-N-CA 125.787 1.635 . . . . 71.24 114.045 177.182 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 88.2 p -64.62 149.21 49.35 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 113.045 0.758 . . . . 74.14 113.045 -172.176 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.518 ' HG2' ' H ' ' A' ' 69' ' ' CYS . 73.2 tttt -108.84 -151.5 0.47 Allowed 'General case' 0 CA--C 1.568 1.665 0 C-N-CA 123.933 0.893 . . . . 62.14 109.298 -177.569 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.518 ' H ' ' HG2' ' A' ' 68' ' ' LYS . 62.4 m 73.18 -15.74 0.52 Allowed 'General case' 0 N--CA 1.501 2.076 0 C-N-CA 125.1 1.36 . . . . 51.45 113.737 178.918 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 21.1 mtm180 . . . . . 0 CA--C 1.565 1.55 0 C-N-CA 124.125 0.97 . . . . 72.14 110.042 179.905 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 33.2 m . . . . . 0 N--CA 1.486 1.359 0 N-CA-C 110.706 -0.109 . . . . 40.25 110.706 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 85.1 m-70 -136.53 137.06 39.89 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.461 0.704 . . . . 73.11 111.009 177.828 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 22.9 ptp -134.08 145.2 49.15 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 123.49 0.716 . . . . 70.21 110.598 177.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -79.67 96.77 6.3 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.28 0.632 . . . . 72.41 110.121 178.393 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -81.29 70.98 8.26 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-O 121.721 0.772 . . . . 74.44 111.271 -179.464 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 10.2 m -84.63 102.29 10.37 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 CA-C-N 115.493 -0.776 . . . . 53.3 109.824 177.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 34.1 pt -77.5 -27.72 15.76 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 C-N-CA 123.815 0.846 . . . . 65.45 113.019 -168.527 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.582 ' HG3' ' HB3' ' A' ' 63' ' ' LEU . 42.9 mmtm 69.75 140.87 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 125.263 1.425 . . . . 72.25 113.261 -173.357 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -65.01 114.49 4.61 Favored 'General case' 0 CA--C 1.552 1.045 0 CA-C-N 115.223 -0.899 . . . . 73.0 109.539 168.218 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.49 ' HA ' ' HE3' ' A' ' 10' ' ' LYS . 0.0 OUTLIER -66.83 124.14 22.11 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.316 0.646 . . . . 72.11 111.544 -179.077 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -68.63 165.53 47.46 Favored Glycine 0 CA--C 1.534 1.281 0 CA-C-N 116.428 -0.351 . . . . 71.34 112.556 170.706 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -68.48 95.6 0.64 Allowed 'General case' 0 N--CA 1.481 1.093 0 CA-C-O 121.513 0.673 . . . . 72.23 111.284 -178.402 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.57 HG22 ' H ' ' A' ' 15' ' ' ILE . 41.3 mm -107.98 131.89 57.13 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.99 0 CA-C-N 115.47 -0.787 . . . . 70.3 109.202 175.834 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 41.5 pt -82.63 -6.43 10.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 C-N-CA 123.308 0.643 . . . . 64.53 112.585 -176.466 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.57 ' H ' HG22 ' A' ' 13' ' ' ILE . 56.0 mt -110.76 146.92 15.27 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 C-N-CA 123.675 0.79 . . . . 54.12 111.013 -178.629 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 63.0 tp -62.09 104.66 0.49 Allowed 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 124.426 1.09 . . . . 72.33 111.171 175.746 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 95.4 m95 -131.28 120.56 23.36 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.823 0.849 . . . . 65.04 110.025 176.479 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 27.1 p -106.03 166.88 10.18 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.2 0.6 . . . . 65.35 109.845 179.236 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.47 -20.77 66.39 Favored 'General case' 0 CA--C 1.552 1.048 0 CA-C-N 115.923 -0.58 . . . . 74.12 112.461 175.784 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -73.13 -43.33 61.78 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.651 0.78 . . . . 63.41 110.66 173.689 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -57.84 -44.95 86.82 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.893 0.477 . . . . 74.13 110.848 171.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 -56.64 -53.13 61.19 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 124.111 0.964 . . . . 73.21 111.511 176.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 19.8 tpp180 -55.64 -47.76 76.11 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.911 0.884 . . . . 74.15 111.636 179.577 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 82.2 t -66.64 -43.7 90.2 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.152 0 C-N-CA 122.936 0.494 . . . . 72.42 112.137 -177.438 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 73.4 mt -56.79 -53.01 47.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 CA-C-N 118.324 0.511 . . . . 74.44 111.18 175.814 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.418 HD11 HD22 ' A' ' 60' ' ' LEU . 73.3 mt -61.25 -37.49 83.28 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 123.789 0.836 . . . . 74.41 112.231 -179.53 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 36.2 tp -73.78 -58.15 3.5 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.336 0.654 . . . . 62.23 111.734 -176.439 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.601 ' HB2' HD21 ' A' ' 42' ' ' LEU . 4.2 mm-40 -66.89 -23.51 66.01 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.141 0.576 . . . . 74.13 112.1 -175.286 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 99.2 m -70.77 -29.92 66.26 Favored 'General case' 0 N--CA 1.493 1.715 0 C-N-CA 122.932 0.493 . . . . 73.23 111.742 172.885 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -77.58 -25.89 50.34 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.874 -0.517 . . . . 74.34 111.438 172.573 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.1 mpmm? -76.17 -62.74 1.51 Allowed 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.59 0.756 . . . . 72.25 111.633 178.807 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 7.4 mpt_? -93.13 -2.73 55.09 Favored 'General case' 0 N--CA 1.49 1.525 0 N-CA-C 112.826 0.676 . . . . 73.2 112.826 -174.669 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.73 146.22 18.6 Favored Glycine 0 N--CA 1.487 2.041 0 CA-C-O 119.095 -0.836 . . . . 65.3 112.602 -173.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -77.49 43.05 1.25 Allowed 'Trans proline' 0 C--N 1.376 1.991 0 C-N-CA 123.373 2.715 . . . . 64.52 113.543 -177.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 42.6 m -97.35 168.68 10.26 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.18 0.992 . . . . 61.43 111.543 -177.084 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.429 ' HA ' ' HD2' ' A' ' 39' ' ' PHE . 89.9 p -61.1 -30.87 70.62 Favored 'General case' 0 N--CA 1.499 1.99 0 C-N-CA 123.35 0.66 . . . . 75.2 112.26 179.282 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 62.3 tttm -58.45 -28.24 65.11 Favored 'General case' 0 CA--C 1.559 1.318 0 C-N-CA 124.392 1.077 . . . . 71.31 112.165 175.252 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 59.4 m -93.26 -34.23 13.64 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.524 0.73 . . . . 73.33 110.959 -178.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' PHE . . . . . 0.429 ' HD2' ' HA ' ' A' ' 36' ' ' SER . 33.8 m-85 -62.54 -33.69 75.43 Favored 'General case' 0 N--CA 1.489 1.518 0 CA-C-O 121.153 0.501 . . . . 74.52 111.418 174.271 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.16 -41.36 94.78 Favored 'General case' 0 CA--C 1.557 1.234 0 C-N-CA 123.693 0.797 . . . . 73.22 111.493 173.22 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 77.0 t80 -62.34 -52.33 64.09 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.825 0.85 . . . . 64.13 111.209 174.729 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.601 HD21 ' HB2' ' A' ' 28' ' ' GLU . 80.7 mt -60.24 -31.37 70.13 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 125.094 1.357 . . . . 75.33 113.031 -178.764 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.37 -53.37 58.4 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.326 0.65 . . . . 70.55 111.639 175.631 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.56 -27.76 62.41 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 122.859 0.463 . . . . 22.23 111.968 177.031 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -72.66 -30.51 64.34 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 124.153 0.981 . . . . 74.21 111.787 -178.157 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 97.0 mt -116.33 4.66 13.46 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.618 0.767 . . . . 52.22 112.427 -177.36 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 61.34 27.53 17.16 Favored 'General case' 0 N--CA 1.497 1.9 0 C-N-CA 124.231 1.013 . . . . 72.45 112.594 -176.699 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -102.54 -174.67 2.62 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.369 1.067 . . . . 72.44 111.132 179.429 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -107.71 140.66 21.79 Favored Pre-proline 0 N--CA 1.486 1.353 0 C-N-CA 123.656 0.782 . . . . 74.2 109.402 175.692 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -56.43 -34.58 94.91 Favored 'Trans proline' 0 C--N 1.387 2.569 0 C-N-CA 123.105 2.536 . . . . 54.23 113.644 -172.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -60.35 -48.05 83.42 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.183 0.993 . . . . 73.52 111.024 175.12 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -72.97 -30.24 63.67 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.687 0.795 . . . . 64.42 111.681 -177.041 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 71.4 t -65.52 -44.03 94.14 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 123.292 0.637 . . . . 75.04 110.55 173.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 44.1 t -64.57 -42.97 95.29 Favored 'General case' 0 N--CA 1.485 1.302 0 CA-C-N 115.952 -0.567 . . . . 75.44 111.265 177.123 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -60.73 -44.47 96.6 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 123.576 0.751 . . . . 72.43 111.944 175.096 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 16.3 tpt180 -68.57 -39.15 81.12 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 122.642 0.377 . . . . 72.3 111.201 179.729 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -58.44 -53.03 62.97 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 124.063 0.945 . . . . 73.35 111.631 179.111 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.461 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 66.6 mt-30 -73.04 -26.7 61.39 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-N 115.324 -0.853 . . . . 71.11 111.226 -176.243 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 12.3 tm0? -69.7 -41.59 75.18 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 123.6 0.76 . . . . 72.21 109.366 173.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.418 HD22 HD11 ' A' ' 26' ' ' LEU . 13.0 mt -56.15 -48.13 76.87 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 124.355 1.062 . . . . 73.53 110.895 172.556 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 29.2 mmt -55.3 -46.35 76.24 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.235 0.614 . . . . 72.15 111.22 176.382 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' A' ' 58' ' ' GLN . 34.8 mmtp -58.55 -39.38 80.05 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 123.524 0.73 . . . . 73.02 112.316 177.155 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.582 ' HB3' ' HG3' ' A' ' 8' ' ' LYS . 97.6 mt -61.14 -52.83 63.21 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.142 0.577 . . . . 71.31 111.047 176.419 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -62.79 -29.66 70.87 Favored 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 123.047 0.539 . . . . 65.43 112.403 -179.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -68.91 -59.22 3.21 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 122.972 0.509 . . . . 72.41 110.924 174.498 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.622 ' HG2' ' H ' ' A' ' 68' ' ' LYS . 39.9 ttmt -175.62 140.16 0.45 Allowed 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.442 0.697 . . . . 64.5 110.853 -179.307 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 81.7 p -70.93 -26.27 63.12 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.609 0.764 . . . . 62.42 112.048 176.776 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.622 ' H ' ' HG2' ' A' ' 66' ' ' LYS . 67.3 mttm 66.48 -177.24 0.19 Allowed 'General case' 0 N--CA 1.496 1.865 0 C-N-CA 124.869 1.268 . . . . 74.03 111.949 -178.187 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 46.4 t 61.64 20.1 11.02 Favored 'General case' 0 N--CA 1.496 1.861 0 C-N-CA 124.163 0.985 . . . . 73.22 113.571 171.62 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 41.4 ttt-85 . . . . . 0 CA--C 1.565 1.549 0 C-N-CA 123.336 0.654 . . . . 74.34 111.52 -174.522 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 76.4 p . . . . . 0 N--CA 1.498 1.925 0 N-CA-C 111.182 0.067 . . . . 42.21 111.182 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 38.0 m80 -63.76 -59.69 4.24 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.191 0.597 . . . . 71.33 111.127 176.455 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 53.5 mtm 61.56 -176.21 0.12 Allowed 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 124.282 1.033 . . . . 73.53 112.836 177.485 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -158.73 88.59 0.92 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 123.42 0.688 . . . . 71.32 109.213 174.28 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -120.4 18.74 12.13 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-O 122.151 0.977 . . . . 70.14 109.638 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 33.5 m -93.51 20.98 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 C-N-CA 124.322 1.049 . . . . 61.13 112.11 -175.663 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.0 mp -74.21 92.4 0.68 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.2 0 C-N-CA 123.448 0.699 . . . . 71.15 110.765 -172.681 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -170.32 163.4 8.74 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 124.849 1.26 . . . . 62.31 110.696 177.361 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.4 tmtt? -139.22 64.97 1.45 Allowed 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 109.086 -0.709 . . . . 74.42 109.086 176.776 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -176.1 149.11 0.86 Allowed 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 124.25 1.02 . . . . 73.44 109.83 178.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 78.94 91.86 0.36 Allowed Glycine 0 C--N 1.346 1.118 0 N-CA-C 112.466 -0.254 . . . . 52.22 112.466 -178.117 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -77.81 12.04 1.89 Allowed 'General case' 0 CA--C 1.561 1.383 0 C-N-CA 124.108 0.963 . . . . 65.42 113.147 -171.805 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.413 ' H ' HD12 ' A' ' 13' ' ' ILE . 3.4 mp -69.08 122.73 21.08 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 C-N-CA 123.412 0.685 . . . . 42.12 109.586 175.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 30.6 pt -76.76 -8.71 11.94 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 N-CA-C 113.759 1.022 . . . . 64.45 113.759 -170.686 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 65.9 mt -98.93 118.12 45.03 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 C-N-CA 123.329 0.652 . . . . 75.23 110.463 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.8 tp -83.09 115.94 22.1 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.393 0.677 . . . . 63.41 111.038 178.066 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' TRP . . . . . 0.686 ' HZ2' ' HB3' ' A' ' 52' ' ' GLN . 81.6 m95 -104.18 112.32 25.29 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.891 0.876 . . . . 74.41 109.89 172.182 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 43.9 p -96.67 161.52 13.84 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 122.814 0.446 . . . . 51.13 110.834 -178.177 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 35.0 ptt180 -57.65 -23.26 50.33 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.527 0.731 . . . . 74.45 111.904 171.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -69.69 -46.24 66.47 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 123.905 0.882 . . . . 75.44 110.73 175.524 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.4 m-20 -58.61 -47.09 85.52 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.017 0.527 . . . . 53.13 111.234 174.198 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.448 ' HB3' HD21 ' A' ' 60' ' ' LEU . 56.5 m-20 -55.94 -47.16 78.07 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.157 0.983 . . . . 75.25 112.254 176.844 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 32.3 ttm180 -61.57 -40.22 93.98 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.915 0.486 . . . . 72.51 112.016 179.737 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 85.4 t -69.27 -40.0 79.75 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 122.73 0.412 . . . . 72.45 111.643 178.649 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 81.3 mt -58.88 -43.58 88.75 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 CA-C-O 120.877 0.37 . . . . 54.23 110.991 175.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 88.5 mt -70.94 -35.04 72.04 Favored 'General case' 0 CA--C 1.555 1.149 0 C-N-CA 123.287 0.635 . . . . 73.53 111.694 176.139 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 31.0 tp -67.27 -52.0 46.11 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.862 0.865 . . . . 71.34 111.719 -176.293 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -74.42 -20.49 60.03 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.123 0.569 . . . . 65.15 111.684 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 53.4 t -72.08 -34.7 68.89 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 122.85 0.46 . . . . 72.23 111.174 171.2 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -79.74 -15.61 57.18 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.158 0.583 . . . . 72.53 111.423 172.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 56.2 tptt -80.78 -48.38 12.56 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 123.694 0.798 . . . . 64.32 110.94 175.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 50.6 mtt180 -106.46 -63.58 1.26 Allowed 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.737 0.815 . . . . 75.43 111.447 -178.537 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 136.7 154.1 6.66 Favored Glycine 0 CA--C 1.539 1.544 0 CA-C-O 119.086 -0.841 . . . . 71.12 111.694 -172.196 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_exo -57.68 109.08 0.43 Allowed 'Trans proline' 0 C--N 1.374 1.88 0 C-N-CA 123.128 2.552 . . . . 44.31 113.168 176.319 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 46.7 t -156.39 155.37 32.03 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.316 0.646 . . . . 71.43 111.371 -177.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 58.4 p -62.91 -33.47 75.4 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.547 0.739 . . . . 73.31 111.23 172.286 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -63.96 -33.85 76.65 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.516 0.726 . . . . 73.35 111.124 173.424 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 38.4 m -83.36 -27.98 29.29 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 123.276 0.63 . . . . 55.42 110.192 -176.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 22.5 m-30 -69.35 -36.29 76.73 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.242 0.617 . . . . 63.34 110.849 172.483 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.02 -39.84 87.12 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 123.451 0.7 . . . . 73.2 110.924 173.728 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -65.54 -39.52 91.84 Favored 'General case' 0 CA--C 1.557 1.242 0 C-N-CA 124.425 1.09 . . . . 73.12 111.876 176.304 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.465 ' HB2' HG11 ' A' ' 53' ' ' VAL . 39.5 mt -73.41 -29.28 62.49 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 124.168 0.987 . . . . 72.14 112.248 175.767 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.47 -39.18 93.77 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 122.867 0.467 . . . . 55.25 110.385 171.514 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -71.36 -43.27 67.24 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 123.52 0.728 . . . . 43.33 112.001 175.281 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -70.05 -39.91 75.41 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.937 0.895 . . . . 71.14 112.09 -172.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 91.9 mt -100.26 -3.48 31.33 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.601 0.761 . . . . 75.43 112.962 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 60.15 25.01 14.32 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 124.246 1.018 . . . . 72.44 112.311 -177.192 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 48.6 mmtm -94.43 171.9 8.53 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 124.197 0.999 . . . . 71.15 110.291 177.324 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 37.4 m-80 -75.62 145.05 78.17 Favored Pre-proline 0 N--CA 1.486 1.333 0 CA-C-O 118.944 -0.55 . . . . 64.31 110.127 174.359 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -60.42 -28.83 87.49 Favored 'Trans proline' 0 C--N 1.381 2.252 0 C-N-CA 122.443 2.096 . . . . 73.32 112.503 178.146 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -72.27 -39.53 68.3 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.283 1.033 . . . . 71.35 110.629 177.413 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.686 ' HB3' ' HZ2' ' A' ' 17' ' ' TRP . 24.3 mm-40 -63.73 -38.27 90.49 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.603 0.761 . . . . 73.15 111.906 173.419 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.465 HG11 ' HB2' ' A' ' 42' ' ' LEU . 69.6 t -69.64 -48.88 63.0 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 C-N-CA 123.268 0.627 . . . . 73.11 111.877 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 79.9 p -58.04 -42.72 86.0 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 123.117 0.567 . . . . 71.32 111.48 179.001 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -61.83 -52.58 63.58 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.989 0.516 . . . . 71.11 112.203 173.774 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 28.4 tpt180 -65.25 -31.3 72.39 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 122.896 0.479 . . . . 73.43 112.108 -174.576 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -57.27 -52.28 65.95 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.869 0.868 . . . . 73.02 110.847 171.839 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -73.77 -23.36 59.71 Favored 'General case' 0 CA--C 1.552 1.035 0 CA-C-N 115.472 -0.786 . . . . 64.04 112.219 -176.516 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.451 ' O ' ' HG ' ' A' ' 63' ' ' LEU . 36.1 mm-40 -65.86 -46.94 76.6 Favored 'General case' 0 N--CA 1.484 1.259 0 N-CA-C 109.469 -0.567 . . . . 43.44 109.469 168.779 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.448 HD21 ' HB3' ' A' ' 22' ' ' ASP . 21.6 mt -58.62 -45.22 89.68 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.298 1.039 . . . . 70.5 112.304 175.77 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 36.0 mmt -59.96 -36.18 76.54 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 121.261 0.553 . . . . 74.21 111.295 177.411 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 17.3 tptp -68.96 -32.13 71.49 Favored 'General case' 0 CA--C 1.561 1.369 0 C-N-CA 123.858 0.863 . . . . 74.14 110.919 177.32 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.451 ' HG ' ' O ' ' A' ' 59' ' ' GLN . 70.9 mt -75.87 -30.59 58.93 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.767 0.827 . . . . 73.12 111.884 177.722 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -62.62 -29.03 70.31 Favored 'General case' 0 N--CA 1.495 1.792 0 C-N-CA 122.875 0.47 . . . . 64.42 111.67 172.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -65.71 -59.36 3.99 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.01 0.524 . . . . 75.22 109.819 170.161 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -172.28 125.54 0.52 Allowed 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.027 0.931 . . . . 73.21 109.987 179.382 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 64.0 m -83.23 85.75 7.15 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-O 121.381 0.61 . . . . 52.25 109.998 175.332 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 45.0 tttm -96.33 137.11 35.89 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.612 1.165 . . . . 72.42 110.474 179.119 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 51.0 t 66.11 -66.93 0.16 Allowed 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 125.134 1.374 . . . . 71.31 111.2 -169.481 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 29.8 mmm180 . . . . . 0 CA--C 1.563 1.469 0 C-N-CA 123.464 0.705 . . . . 70.23 109.981 173.121 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 64.8 p . . . . . 0 N--CA 1.488 1.465 0 CA-C-O 120.569 0.223 . . . . 72.53 110.765 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 84.2 m-70 -139.23 -57.42 0.6 Allowed 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 124.007 0.923 . . . . 72.41 110.414 175.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' MET . . . . . 0.507 ' HG2' ' H ' ' A' ' 4' ' ' LYS . 31.2 ttm 60.23 -174.44 0.11 Allowed 'General case' 0 CA--C 1.572 1.797 0 C-N-CA 124.385 1.074 . . . . 75.54 110.638 -174.335 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.507 ' H ' ' HG2' ' A' ' 3' ' ' MET . 4.6 ttmp? 69.63 -1.17 2.36 Favored 'General case' 0 N--CA 1.503 2.181 0 N-CA-C 113.605 0.965 . . . . 72.32 113.605 167.677 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -77.86 174.74 10.7 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.63 0.772 . . . . 73.33 111.93 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 40.5 t 61.92 75.44 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 C-N-CA 124.48 1.112 . . . . 64.44 109.549 -168.286 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.0 mp -77.96 102.11 4.1 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.923 0 CA-C-N 115.12 -0.945 . . . . 70.2 109.611 -173.591 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -123.65 138.48 54.53 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.632 0.773 . . . . 41.21 110.314 177.625 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 44.6 pttt -151.76 159.03 44.09 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 124.635 1.174 . . . . 61.01 109.771 -176.657 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 48.6 mtmt 65.76 -170.32 0.2 Allowed 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 124.748 1.219 . . . . 64.2 111.819 -170.204 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 123.12 169.58 13.31 Favored Glycine 0 N--CA 1.475 1.269 0 CA-C-N 116.425 -0.352 . . . . 51.23 112.849 177.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.475 ' HG3' ' HG3' ' A' ' 70' ' ' ARG . 34.6 mm-40 -87.67 96.91 10.6 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 123.059 0.544 . . . . 74.14 112.083 -178.464 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.3 mp -118.28 122.36 69.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 N-CA-C 108.496 -0.927 . . . . 71.34 108.496 169.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 37.8 pt -81.0 -22.63 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 C-N-CA 122.964 0.506 . . . . 63.21 112.09 179.194 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 29.1 mt -95.2 156.69 3.17 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.353 0 C-N-CA 124.378 1.071 . . . . 65.45 109.661 177.73 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 33.8 tp -78.41 91.16 4.46 Favored 'General case' 0 CA--C 1.562 1.43 0 O-C-N 121.692 -0.63 . . . . 62.22 110.705 175.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 89.6 m95 -117.84 146.33 43.95 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 124.732 1.213 . . . . 71.33 110.061 175.192 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 15.8 p -101.59 165.78 11.05 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 109.902 -0.407 . . . . 71.54 109.902 173.068 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 20.2 ptp180 -66.55 -21.37 66.15 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.211 0.604 . . . . 75.22 111.281 177.153 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.415 ' O ' HG23 ' A' ' 24' ' ' VAL . 5.8 m120 -75.58 -50.67 14.87 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.167 0.987 . . . . 63.54 110.097 179.81 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 52.7 m-20 -63.59 -42.31 98.28 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.132 0.573 . . . . 74.04 110.606 177.153 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -53.87 -50.42 66.31 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 125.034 1.334 . . . . 63.01 111.281 176.115 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.6 -29.14 65.47 Favored 'General case' 0 CA--C 1.558 1.257 0 CA-C-N 115.305 -0.861 . . . . 65.32 112.014 -178.724 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 20' ' ' ASN . 53.7 t -68.93 -40.88 81.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 C-N-CA 122.717 0.407 . . . . 54.42 110.952 173.831 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 86.8 mt -56.99 -59.42 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.364 0 O-C-N 123.306 0.378 . . . . 73.02 110.288 175.832 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.545 HD11 HD22 ' A' ' 60' ' ' LEU . 83.9 mt -59.8 -34.1 72.59 Favored 'General case' 0 N--CA 1.485 1.302 0 N-CA-C 112.833 0.679 . . . . 61.23 112.833 -176.486 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 37.6 tp -75.93 -57.0 4.13 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.135 0.574 . . . . 74.1 112.255 -175.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.749 ' HB2' HD21 ' A' ' 42' ' ' LEU . 24.5 mt-10 -77.75 -18.81 56.1 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 112.893 0.701 . . . . 74.22 112.893 -176.49 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.479 ' SG ' ' HA ' ' A' ' 34' ' ' PRO . 43.1 t -70.9 -51.01 28.8 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.635 0.374 . . . . 63.11 110.922 176.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -66.87 -27.91 67.91 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 122.863 0.465 . . . . 71.52 111.61 174.622 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 59.9 tptt -65.05 -50.08 67.61 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.814 0.845 . . . . 53.23 111.057 176.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 61.3 mtp85 -100.6 11.67 39.0 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 112.766 0.654 . . . . 71.13 112.766 -175.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 79.51 110.8 0.24 Allowed Glycine 0 CA--C 1.544 1.892 0 CA-C-O 118.762 -1.021 . . . . 61.23 112.377 178.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.479 ' HA ' ' SG ' ' A' ' 29' ' ' CYS . 20.1 Cg_endo -57.53 99.34 0.09 OUTLIER 'Trans proline' 0 C--N 1.382 2.32 0 C-N-CA 123.373 2.716 . . . . 52.24 113.691 -173.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 23.0 t -157.37 174.22 15.74 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.224 0.609 . . . . 74.23 112.004 -172.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 60.5 p -55.5 -50.33 70.22 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 124.78 1.232 . . . . 73.14 113.689 -175.47 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 26.5 mtpp -69.22 -15.13 63.31 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 112.9 0.704 . . . . 54.33 112.9 -178.82 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.404 HG21 ' HA ' ' A' ' 29' ' ' CYS . 27.5 m -87.31 -34.06 19.0 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.469 0.708 . . . . 60.34 109.693 177.124 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -66.67 -35.67 80.7 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.212 0.605 . . . . 73.2 110.847 173.203 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.41 -36.55 83.11 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.455 0.702 . . . . 55.52 111.775 175.226 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -63.24 -55.66 23.05 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.376 0.67 . . . . 71.23 111.216 172.908 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.749 HD21 ' HB2' ' A' ' 28' ' ' GLU . 81.2 mt -62.17 -23.25 66.48 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 124.177 0.991 . . . . 75.05 112.616 178.906 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.3 -57.7 8.63 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.347 0.659 . . . . 70.43 111.32 173.617 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.9 -30.67 71.3 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-N 115.876 -0.602 . . . . 62.11 111.666 178.777 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.405 ' HA ' ' HE2' ' A' ' 45' ' ' LYS . 0.5 OUTLIER -68.28 -42.87 78.89 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 123.703 0.801 . . . . 75.24 111.78 177.801 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 89.8 mt -104.25 12.85 33.2 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 123.485 0.714 . . . . 74.22 112.831 -175.448 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.2 t70 64.18 16.09 9.8 Favored 'General case' 0 CA--C 1.575 1.911 0 C-N-CA 124.064 0.946 . . . . 74.32 112.558 175.549 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -107.83 -175.11 2.69 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.777 0.831 . . . . 74.45 112.008 -178.431 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -91.65 150.98 41.93 Favored Pre-proline 0 N--CA 1.484 1.236 0 C-N-CA 123.302 0.641 . . . . 73.21 110.145 176.608 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 79.1 Cg_exo -52.59 -35.41 67.18 Favored 'Trans proline' 0 C--N 1.384 2.402 0 C-N-CA 122.857 2.371 . . . . 54.35 113.618 174.781 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 15.0 t-20 -64.46 -46.9 81.13 Favored 'General case' 0 CA--C 1.557 1.248 0 C-N-CA 123.172 0.589 . . . . 73.31 110.43 176.379 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -54.78 -46.84 74.47 Favored 'General case' 0 N--CA 1.499 1.977 0 C-N-CA 123.743 0.817 . . . . 73.22 112.008 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.536 HG11 ' HB2' ' A' ' 42' ' ' LEU . 69.4 t -65.7 -45.41 92.06 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 CA-C-N 115.286 -0.87 . . . . 65.32 111.183 179.728 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' SER . . . . . 0.445 ' O ' ' HG3' ' A' ' 58' ' ' GLN . 35.0 t -58.09 -43.39 87.06 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.344 0.658 . . . . 71.31 111.6 177.286 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -62.09 -53.91 48.71 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.511 0.725 . . . . 72.14 111.64 178.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.409 ' HA ' ' HD2' ' A' ' 56' ' ' ARG . 10.7 tpt180 -61.59 -38.49 87.76 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 122.683 0.393 . . . . 75.42 111.621 -178.704 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -55.46 -52.62 63.02 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.853 0.861 . . . . 74.43 112.134 174.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.445 ' HG3' ' O ' ' A' ' 54' ' ' SER . 83.3 mt-30 -73.59 -24.39 60.06 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.326 0.65 . . . . 75.5 112.136 -175.493 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.459 ' O ' ' HG ' ' A' ' 63' ' ' LEU . 19.1 mm-40 -68.3 -43.61 77.29 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 122.998 0.519 . . . . 63.23 109.641 170.113 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.545 HD22 HD11 ' A' ' 26' ' ' LEU . 14.3 mt -60.59 -45.55 93.53 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.285 1.034 . . . . 51.23 112.262 176.057 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 35.1 mmt -57.81 -43.73 85.87 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.364 0.666 . . . . 64.41 110.768 175.024 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.49 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 0.2 OUTLIER -64.88 -31.58 72.87 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 123.893 0.877 . . . . 60.34 111.841 178.222 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' A' ' 59' ' ' GLN . 97.6 mt -72.93 -35.9 67.12 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.295 0.638 . . . . 75.11 111.717 175.734 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 47.4 m-85 -65.29 -27.56 68.71 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-O 120.865 0.364 . . . . 72.31 111.232 173.373 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -80.18 -41.55 25.07 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.643 0.777 . . . . 52.2 111.396 173.596 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -165.13 110.61 0.92 Allowed 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 124.121 0.968 . . . . 60.51 110.956 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 16.4 t -123.48 24.72 8.52 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.95 0.9 . . . . 70.34 111.21 178.474 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -58.61 -42.8 89.0 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 123.079 0.552 . . . . 63.14 111.523 177.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' CYS . . . . . 0.447 ' SG ' ' HD2' ' A' ' 70' ' ' ARG . 42.6 t -149.59 -78.4 0.14 Allowed 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.688 0.795 . . . . 62.32 109.09 175.074 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.475 ' HG3' ' HG3' ' A' ' 12' ' ' GLU . 4.6 mpt_? . . . . . 0 C--O 1.26 1.609 0 N-CA-C 108.502 -0.925 . . . . 64.42 108.502 165.009 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 64.0 p . . . . . 0 N--CA 1.489 1.482 0 CA-C-O 120.769 0.318 . . . . 55.03 111.145 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -107.79 -25.64 11.16 Favored 'General case' 0 CA--C 1.56 1.33 0 C-N-CA 124.017 0.927 . . . . 74.34 110.079 175.826 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 24.5 ptp -63.13 160.22 15.83 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 124.003 0.921 . . . . 61.21 112.985 -179.761 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -156.35 -174.38 4.92 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.479 0.712 . . . . 64.51 110.611 -179.074 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -116.59 139.61 50.31 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 123.826 0.85 . . . . 74.11 109.645 165.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.6 p -94.14 -32.15 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 C-N-CA 122.888 0.475 . . . . 62.1 111.589 179.182 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 44.2 mm 59.07 92.89 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.326 0 C-N-CA 125.163 1.385 . . . . 65.34 112.649 -178.485 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 59.8 mttp -123.78 113.65 18.85 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.577 0.751 . . . . 64.44 109.532 168.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -149.03 161.13 42.55 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.372 0.669 . . . . 72.04 110.565 176.861 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 45.2 tptt 61.95 30.07 17.96 Favored 'General case' 0 CA--C 1.566 1.582 0 C-N-CA 124.2 1.0 . . . . 73.14 111.704 178.637 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -78.13 61.49 3.79 Favored Glycine 0 C--N 1.354 1.57 0 CA-C-N 115.926 -0.579 . . . . 74.33 111.893 172.811 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -90.21 17.11 7.44 Favored 'General case' 0 CA--C 1.564 1.513 0 C-N-CA 124.805 1.242 . . . . 75.41 111.606 -169.702 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.9 pp -64.51 145.65 13.72 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.261 0 C-N-CA 123.752 0.821 . . . . 73.12 112.242 175.548 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 16.4 tt -74.07 -16.89 16.95 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 C-N-CA 123.835 0.854 . . . . 62.44 112.286 -176.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 19.2 mt -76.96 143.01 13.51 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.062 0 C-N-CA 124.027 0.931 . . . . 70.53 110.839 -177.75 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.7 tt -75.54 115.33 15.09 Favored 'General case' 0 CA--C 1.558 1.282 0 C-N-CA 123.414 0.686 . . . . 74.43 109.792 178.141 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' TRP . . . . . 0.583 ' HZ3' HD13 ' A' ' 46' ' ' LEU . 98.6 m95 -140.56 145.68 37.07 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 124.657 1.183 . . . . 75.33 110.414 176.213 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 18.0 p -122.2 158.16 30.02 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 109.259 -0.645 . . . . 71.12 109.259 170.278 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.6 ptp180 -63.24 -19.04 64.19 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 123.562 0.745 . . . . 72.02 112.673 176.541 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.471 ' O ' HG23 ' A' ' 24' ' ' VAL . 25.5 m-80 -68.55 -46.71 68.75 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.124 0.57 . . . . 74.24 109.755 170.964 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -62.92 -43.57 98.42 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 123.589 0.756 . . . . 74.5 111.24 176.262 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.674 ' HB3' HD21 ' A' ' 60' ' ' LEU . 68.7 m-20 -56.51 -42.68 78.8 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.742 1.217 . . . . 64.22 111.768 175.69 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 32.5 ttm180 -61.37 -45.68 93.35 Favored 'General case' 0 N--CA 1.483 1.186 0 CA-C-N 115.48 -0.782 . . . . 63.21 110.917 175.467 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.471 HG23 ' O ' ' A' ' 20' ' ' ASN . 78.2 t -62.34 -41.69 92.6 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 C-N-CA 123.988 0.915 . . . . 72.43 112.207 -177.835 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 88.6 mt -61.2 -52.86 56.5 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 C-N-CA 122.327 0.251 . . . . 72.42 110.803 177.429 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.491 ' HG ' HD13 ' A' ' 60' ' ' LEU . 94.1 mt -58.65 -37.08 75.19 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.489 0.716 . . . . 74.33 112.18 176.829 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 28.3 tp -74.82 -50.55 16.78 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.61 0.764 . . . . 61.32 111.706 -174.351 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -74.64 -18.74 60.5 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 123.171 0.588 . . . . 54.11 112.162 -177.519 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 87.2 m -66.17 -30.14 70.56 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 122.628 0.371 . . . . 52.55 111.092 166.366 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLN . . . . . 0.402 ' HG2' ' O ' ' A' ' 26' ' ' LEU . 12.6 mm100 -81.91 -24.49 35.64 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.995 0.518 . . . . 72.42 111.868 174.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.1 mptm? -71.83 -73.23 0.19 Allowed 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 121.27 0.557 . . . . 63.53 110.739 169.34 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.568 HH21 ' HG2' ' A' ' 37' ' ' LYS . 18.2 mtp180 -84.41 -53.99 5.07 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 123.941 0.896 . . . . 74.32 112.032 -171.238 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 131.25 163.35 10.87 Favored Glycine 0 N--CA 1.482 1.763 0 CA-C-O 119.525 -0.597 . . . . 73.04 113.076 -179.476 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -67.52 85.7 0.36 Allowed 'Trans proline' 0 C--N 1.379 2.142 0 C-N-CA 122.888 2.392 . . . . 50.33 111.905 173.754 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.2 m -141.72 148.55 39.21 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 124.108 0.963 . . . . 54.13 110.051 -176.802 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 89.9 p -61.76 -31.97 72.2 Favored 'General case' 0 N--CA 1.498 1.945 0 C-N-CA 123.281 0.632 . . . . 64.1 111.478 176.74 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.568 ' HG2' HH21 ' A' ' 32' ' ' ARG . 88.3 tttt -59.17 -34.45 72.13 Favored 'General case' 0 CA--C 1.561 1.397 0 C-N-CA 125.074 1.349 . . . . 71.32 111.751 173.229 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 87.5 m -79.11 -39.33 33.96 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 124.094 0.958 . . . . 72.33 110.18 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 26.7 m-85 -65.86 -26.89 67.85 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 115.179 -0.919 . . . . 72.11 111.95 175.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.31 -36.88 84.07 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.338 0.655 . . . . 70.2 111.668 173.206 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -66.44 -54.51 23.31 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 123.116 0.566 . . . . 74.01 110.642 172.005 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 96.1 mt -60.7 -23.06 64.58 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.459 1.104 . . . . 71.32 112.41 178.643 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.65 -57.5 9.86 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.231 0.612 . . . . 72.5 111.467 174.404 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -68.52 -27.58 66.24 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-N 115.544 -0.753 . . . . 75.23 112.161 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.451 ' HD3' HD23 ' A' ' 46' ' ' LEU . 0.6 OUTLIER -70.64 -58.18 3.94 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.731 0.813 . . . . 71.45 109.711 179.608 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.583 HD13 ' HZ3' ' A' ' 17' ' ' TRP . 41.4 mt -83.23 -5.35 59.1 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.475 0.71 . . . . 72.44 112.614 -173.402 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.1 t70 72.73 -2.71 2.58 Favored 'General case' 0 N--CA 1.498 1.935 0 C-N-CA 125.006 1.322 . . . . 64.14 112.146 -177.129 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.469 ' HA ' ' HE2' ' A' ' 48' ' ' LYS . 11.5 mmpt? -97.55 137.58 36.27 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.772 0.829 . . . . 70.03 110.058 -177.142 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 36.0 m-80 -52.19 149.44 9.77 Favored Pre-proline 0 N--CA 1.494 1.767 0 C-N-CA 123.49 0.716 . . . . 72.3 112.645 178.604 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -59.32 -22.12 63.87 Favored 'Trans proline' 0 C--N 1.387 2.601 0 C-N-CA 122.828 2.352 . . . . 52.02 113.082 -176.06 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -68.22 -43.76 77.28 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 124.022 0.929 . . . . 75.34 110.896 172.913 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 11.4 mm-40 -65.73 -41.88 91.7 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.393 0.677 . . . . 72.13 111.076 178.263 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 99.2 t -69.36 -43.83 80.73 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 C-N-CA 123.573 0.749 . . . . 64.24 111.807 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 93.5 p -62.67 -39.48 94.06 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.097 0.559 . . . . 74.4 111.029 179.514 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -72.5 -36.69 68.46 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 115.824 -0.625 . . . . 70.23 112.01 175.849 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -67.63 -34.97 78.05 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 122.775 0.43 . . . . 74.53 111.398 -179.195 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -53.63 -45.49 70.17 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.808 0.843 . . . . 75.21 110.242 169.718 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.524 ' O ' ' HG3' ' A' ' 62' ' ' LYS . 40.4 mt-30 -74.48 -30.33 61.8 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 114.984 -1.007 . . . . 74.23 112.052 178.462 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -68.46 -38.62 81.25 Favored 'General case' 0 N--CA 1.497 1.885 0 C-N-CA 123.908 0.883 . . . . 72.1 110.788 178.804 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.674 HD21 ' HB3' ' A' ' 22' ' ' ASP . 32.7 mt -53.62 -51.77 62.0 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.281 1.032 . . . . 62.5 110.245 168.44 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 45.5 mtt -68.88 -25.35 64.57 Favored 'General case' 0 CA--C 1.552 1.041 0 N-CA-C 113.335 0.865 . . . . 72.12 113.335 178.406 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.524 ' HG3' ' O ' ' A' ' 58' ' ' GLN . 60.8 mttp -63.7 -40.8 97.67 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-N 118.368 0.531 . . . . 70.32 110.048 173.356 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 75.2 mt -75.59 -41.6 54.13 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.52 0.728 . . . . 73.32 111.574 177.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 22.8 m-30 -65.2 -28.5 69.43 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.074 0.55 . . . . 75.34 111.598 177.05 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -71.61 -64.07 1.0 Allowed 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 108.698 -0.852 . . . . 73.44 108.698 172.921 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LYS . . . . . 0.488 ' HD3' ' HA ' ' A' ' 66' ' ' LYS . 44.7 mmtt -164.03 -72.54 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 125.612 1.565 . . . . 73.14 109.217 174.667 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 45.8 t -176.93 139.15 0.27 Allowed 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 124.454 1.102 . . . . 54.41 109.746 178.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.5 116.54 2.95 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.338 0.655 . . . . 74.53 110.286 177.062 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 60.9 m -79.83 -13.79 59.15 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.339 0.656 . . . . 55.41 112.658 -178.416 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.7 tmt_? . . . . . 0 CA--C 1.57 1.718 0 C-N-CA 125.311 1.444 . . . . 64.34 110.503 -179.639 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 80.9 p . . . . . 0 N--CA 1.494 1.77 0 CA-C-O 120.355 0.122 . . . . 71.3 110.888 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 77.5 m80 -138.21 120.31 15.63 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 124.014 0.925 . . . . 74.23 109.818 178.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 53.9 ttm -70.5 101.1 1.92 Allowed 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 123.586 0.754 . . . . 65.12 111.092 -178.722 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -115.59 -60.77 1.83 Allowed 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.52 0.728 . . . . 74.13 110.804 -179.595 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -75.43 81.2 2.48 Favored 'General case' 0 N--CA 1.481 1.114 0 CA-C-O 121.388 0.613 . . . . 71.33 109.846 177.908 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.5 p -135.34 137.67 49.63 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 C-N-CA 124.136 0.975 . . . . 73.02 110.275 -178.214 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.1 mp -88.39 107.59 17.79 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.917 0 N-CA-C 109.257 -0.645 . . . . 71.32 109.257 178.29 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.4 mtpp -69.46 83.34 0.4 Allowed 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 108.856 -0.794 . . . . 73.31 108.856 166.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.6 tmtt? -69.71 -57.03 5.63 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 115.642 -0.708 . . . . 73.41 109.267 -175.564 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 47.8 mtpt -138.89 175.94 9.12 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-O 121.68 0.753 . . . . 73.42 111.858 177.343 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 175.63 142.62 4.25 Favored Glycine 0 C--N 1.343 0.924 0 CA-C-N 114.514 -1.221 . . . . 41.31 110.66 174.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -79.86 84.67 5.6 Favored 'General case' 0 CA--C 1.556 1.194 0 CA-C-N 117.597 0.699 . . . . 72.43 109.707 -179.337 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.528 HG23 HH21 ' A' ' 56' ' ' ARG . 4.6 mp -135.42 131.67 51.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 C-N-CA 123.858 0.863 . . . . 72.12 110.001 174.012 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.408 HG23 HG13 ' A' ' 15' ' ' ILE . 14.3 tt -99.26 -28.08 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 C-N-CA 123.756 0.822 . . . . 74.22 111.148 174.872 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.408 HG13 HG23 ' A' ' 14' ' ' ILE . 70.1 mt -83.17 159.1 3.72 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.564 0 C-N-CA 124.689 1.196 . . . . 63.43 111.008 -177.972 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 60.2 tp -67.01 89.14 0.16 Allowed 'General case' 0 CA--C 1.559 1.313 0 CA-C-O 121.364 0.602 . . . . 71.1 112.041 178.433 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' TRP . . . . . 0.506 ' HB2' HG21 ' A' ' 13' ' ' ILE . 95.9 m95 -128.98 124.92 36.28 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.847 0.859 . . . . 72.3 110.212 176.187 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 72.2 p -131.68 168.1 18.32 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.43 1.092 . . . . 72.11 110.521 -172.398 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -56.59 -22.9 36.97 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 123.68 0.792 . . . . 52.21 113.113 -178.776 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.448 ' O ' HG23 ' A' ' 24' ' ' VAL . 10.9 m-80 -71.36 -49.79 38.77 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.54 0.736 . . . . 64.13 110.268 179.615 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.406 ' HB3' HD13 ' A' ' 46' ' ' LEU . 0.4 OUTLIER -72.45 -41.76 65.74 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-N 115.675 -0.693 . . . . 74.02 110.101 -176.524 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.486 ' HB3' HD21 ' A' ' 60' ' ' LEU . 2.1 m-20 -51.31 -44.71 62.0 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 124.735 1.214 . . . . 74.54 111.805 172.253 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 60.6 ttp180 -60.61 -45.88 92.37 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.51 0.724 . . . . 74.24 111.554 175.66 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.448 HG23 ' O ' ' A' ' 20' ' ' ASN . 58.3 t -63.07 -37.0 78.21 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.353 0 C-N-CA 123.567 0.747 . . . . 74.51 111.378 -179.501 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 86.8 mt -64.13 -50.03 78.75 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 C-N-CA 122.813 0.445 . . . . 73.13 110.875 175.7 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 95.3 mt -59.36 -33.08 70.73 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 123.358 0.663 . . . . 63.34 111.946 176.519 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 45.8 tp -69.35 -58.13 4.4 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.41 0.684 . . . . 64.34 110.883 179.368 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.59 ' HA ' ' HB3' ' A' ' 31' ' ' LYS . 75.2 mm-40 -68.26 -23.19 64.75 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.576 0.75 . . . . 71.34 112.614 -177.919 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 54.1 t -68.17 -29.05 67.83 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.208 0.603 . . . . 60.02 111.98 174.246 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -104.02 -15.07 15.7 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 123.2 0.6 . . . . 62.33 112.023 176.488 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.59 ' HB3' ' HA ' ' A' ' 28' ' ' GLU . 43.7 tttm -82.65 -49.52 9.72 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 124.154 0.982 . . . . 64.45 110.805 177.025 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 88.4 mtt180 -99.17 -64.11 1.07 Allowed 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.676 0.79 . . . . 52.32 110.303 171.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 152.39 173.94 22.44 Favored Glycine 0 CA--C 1.539 1.548 0 CA-C-N 115.266 -0.879 . . . . 73.31 111.912 -172.699 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -86.02 31.46 0.47 Allowed 'Trans proline' 0 CA--C 1.56 1.814 0 C-N-CA 123.002 2.468 . . . . 64.11 113.879 -179.471 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 43.2 t -80.09 161.03 25.56 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 123.358 0.663 . . . . 74.33 112.611 -177.845 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 78.3 p -65.49 -28.19 69.02 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 124.099 0.96 . . . . 73.41 111.93 176.429 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -76.65 -18.97 58.28 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.405 0.682 . . . . 72.34 111.743 176.581 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 56.7 m -82.37 -38.4 24.21 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 109.203 -0.665 . . . . 62.34 109.203 171.494 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -64.76 -29.26 70.23 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 115.658 -0.701 . . . . 73.34 110.977 173.058 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ALA . . . . . 0.419 ' HA ' ' HG3' ' A' ' 50' ' ' PRO . . . -70.97 -34.79 71.76 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.668 0.787 . . . . 72.1 111.548 173.708 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -63.5 -54.96 28.16 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 109.726 -0.472 . . . . 72.42 109.726 171.06 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.437 ' HA ' ' HB3' ' A' ' 45' ' ' LYS . 52.2 mt -59.78 -24.73 64.33 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 125.271 1.428 . . . . 54.14 112.972 179.074 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.37 -55.47 17.99 Favored 'General case' 0 CA--C 1.552 1.03 0 CA-C-O 121.045 0.45 . . . . 53.12 110.742 172.35 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.49 -28.43 67.84 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.537 0.735 . . . . 71.04 112.118 177.568 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.437 ' HB3' ' HA ' ' A' ' 42' ' ' LEU . 23.1 tptm -76.2 -38.43 56.53 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.569 1.148 . . . . 72.32 111.594 -176.09 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.406 HD13 ' HB3' ' A' ' 21' ' ' ASP . 62.6 mt -112.52 11.32 19.74 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.659 0.784 . . . . 51.34 112.443 -173.331 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 64.37 21.71 12.56 Favored 'General case' 0 N--CA 1.506 2.359 0 C-N-CA 124.762 1.225 . . . . 54.43 112.684 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -109.94 -163.2 0.84 Allowed 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.725 0.81 . . . . 71.23 111.796 -175.394 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ASN . . . . . 0.493 ' HB2' HE21 ' A' ' 52' ' ' GLN . 13.5 m120 -124.87 147.1 55.39 Favored Pre-proline 0 N--CA 1.487 1.385 0 C-N-CA 123.919 0.888 . . . . 75.21 109.984 178.882 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.419 ' HG3' ' HA ' ' A' ' 40' ' ' ALA . 50.6 Cg_exo -55.25 -27.99 59.72 Favored 'Trans proline' 0 C--N 1.382 2.32 0 C-N-CA 123.547 2.831 . . . . 55.14 115.659 -172.14 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -72.13 -44.81 62.55 Favored 'General case' 0 N--CA 1.494 1.768 0 C-N-CA 123.253 0.621 . . . . 64.21 111.117 176.015 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.493 HE21 ' HB2' ' A' ' 49' ' ' ASN . 43.4 mt-30 -57.46 -41.35 80.39 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 123.887 0.875 . . . . 72.21 111.993 172.912 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.413 HG11 ' HB2' ' A' ' 42' ' ' LEU . 66.8 t -69.78 -43.07 80.18 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.032 0 CA-C-N 115.76 -0.655 . . . . 74.45 111.291 177.722 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 45.2 t -60.01 -34.84 73.89 Favored 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 123.721 0.808 . . . . 73.24 111.658 177.332 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.19 -51.37 54.37 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 114.906 -1.043 . . . . 71.24 110.145 177.774 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.528 HH21 HG23 ' A' ' 13' ' ' ILE . 29.0 mmt-85 -65.8 -30.3 70.91 Favored 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 113.039 0.755 . . . . 63.45 113.039 -179.097 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.411 ' O ' ' HG2' ' A' ' 61' ' ' MET . 19.9 t80 -56.3 -52.94 62.66 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 122.738 0.415 . . . . 75.31 110.502 171.605 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 67.8 mt-30 -73.42 -24.93 60.33 Favored 'General case' 0 CA--C 1.554 1.099 0 CA-C-N 115.574 -0.739 . . . . 72.51 112.074 -176.468 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.417 ' O ' ' HG ' ' A' ' 63' ' ' LEU . 21.2 mm-40 -71.27 -43.11 67.82 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.302 0.641 . . . . 72.53 110.166 172.823 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.486 HD21 ' HB3' ' A' ' 22' ' ' ASP . 25.3 mt -58.64 -45.69 88.74 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 124.31 1.044 . . . . 71.32 111.659 174.687 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.411 ' HG2' ' O ' ' A' ' 57' ' ' PHE . 35.5 mmt -58.07 -39.83 79.49 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.129 0.572 . . . . 60.25 111.167 175.722 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 20.0 tptt -71.63 -28.34 63.71 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 115.65 -0.704 . . . . 63.23 111.8 -178.606 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 59' ' ' GLN . 96.4 mt -66.23 -31.67 72.62 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.288 0.635 . . . . 63.41 111.374 174.562 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -76.31 -43.38 41.57 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 122.962 0.505 . . . . 73.42 111.16 173.494 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -62.15 -45.18 94.56 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.858 0.863 . . . . 72.11 112.509 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -120.13 179.72 4.19 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.687 0.795 . . . . 75.12 112.009 -174.142 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 70.4 m -143.59 103.1 4.04 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.101 0.96 . . . . 65.12 109.533 176.275 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 95.0 mttt 68.73 118.26 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.131 0 C-N-CA 125.163 1.385 . . . . 62.11 112.288 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 83.0 m -72.05 -19.21 61.87 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 124.118 0.967 . . . . 70.42 113.404 -172.39 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 80.9 mtm180 . . . . . 0 CA--C 1.571 1.774 0 C-N-CA 124.554 1.142 . . . . 62.11 113.135 177.945 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 56.3 m . . . . . 0 N--CA 1.483 1.221 0 CA-C-O 121.208 0.528 . . . . 73.2 110.761 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 92.9 m-70 -131.41 106.99 8.61 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 124.428 1.091 . . . . 74.54 109.287 178.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 62.2 mtt -109.29 151.18 26.91 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.582 0.753 . . . . 74.51 111.294 -177.621 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm -69.57 90.43 0.56 Allowed 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 123.071 0.548 . . . . 73.43 111.249 178.48 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -116.43 111.91 20.7 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.992 0.917 . . . . 73.4 108.904 177.475 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 12.5 m -57.06 114.17 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 C-N-CA 123.362 0.665 . . . . 65.44 112.234 -177.754 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 8.5 tt -71.0 95.29 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.56 1.358 0 CA-C-O 122.31 1.052 . . . . 74.14 111.889 -177.566 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -86.5 85.83 7.32 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 115.3 -0.864 . . . . 73.31 109.16 171.293 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.42 52.15 2.28 Favored 'General case' 0 N--CA 1.489 1.488 0 CA-C-N 115.16 -0.927 . . . . 72.13 112.494 -173.854 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -70.83 113.89 8.35 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.853 0.861 . . . . 74.15 110.117 172.291 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 171.0 -145.72 9.13 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 121.757 -0.258 . . . . 65.31 113.298 -178.26 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -103.55 10.09 37.2 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 123.503 0.721 . . . . 73.22 112.755 -174.553 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 26.5 mm -71.09 110.31 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 N-CA-C 109.592 -0.522 . . . . 63.14 109.592 175.057 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 46.0 pt -95.93 0.13 10.5 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 C-N-CA 123.804 0.842 . . . . 70.32 112.126 -177.684 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 3.8 mp -96.38 128.64 47.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 123.566 0.746 . . . . 74.41 109.444 -177.598 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 47.1 tp -71.58 101.36 2.48 Favored 'General case' 0 CA--C 1.556 1.185 0 CA-C-O 121.227 0.537 . . . . 42.21 110.902 179.597 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' TRP . . . . . 0.51 ' HZ2' ' HB3' ' A' ' 52' ' ' GLN . 93.2 m95 -112.13 167.6 10.27 Favored 'General case' 0 CA--C 1.56 1.347 0 C-N-CA 124.926 1.291 . . . . 65.04 110.512 176.919 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 80.6 p -119.54 -174.97 2.85 Favored 'General case' 0 N--CA 1.503 2.191 0 C-N-CA 123.746 0.818 . . . . 72.32 111.848 176.14 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 11.9 ptm180 -77.45 -18.59 57.05 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.243 0.617 . . . . 72.2 112.167 170.242 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.403 ' O ' HG23 ' A' ' 24' ' ' VAL . 77.9 m-20 -67.27 -36.08 80.84 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 123.499 0.719 . . . . 74.15 112.05 -176.887 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.38 -39.86 95.66 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 123.08 0.552 . . . . 74.2 111.035 -177.886 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.616 ' HA ' HD11 ' A' ' 60' ' ' LEU . 27.8 m-20 -49.93 -52.0 36.69 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.695 0.798 . . . . 73.34 111.313 175.487 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 42.0 ttt85 -58.77 -48.67 80.42 Favored 'General case' 0 CA--C 1.559 1.306 0 CA-C-N 114.834 -1.075 . . . . 74.45 112.707 176.327 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 20' ' ' ASN . 89.0 t -65.52 -44.65 94.0 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 C-N-CA 123.896 0.878 . . . . 74.04 112.314 -175.747 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 97.3 mt -69.03 -50.24 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.122 0 C-N-CA 123.711 0.804 . . . . 74.21 111.164 -178.431 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.482 HD11 HD22 ' A' ' 60' ' ' LEU . 95.3 mt -57.79 -27.87 63.5 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 112.421 0.526 . . . . 74.03 112.421 175.616 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.3 tp -74.49 -60.81 2.11 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 122.954 0.502 . . . . 51.13 111.814 177.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.413 ' HB2' HD21 ' A' ' 42' ' ' LEU . 71.2 mm-40 -72.4 -26.35 61.84 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 113.335 0.865 . . . . 74.14 113.335 -172.705 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 71.7 m -67.16 -44.38 79.89 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-O 120.948 0.404 . . . . 74.42 111.7 -178.567 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.6 pt20 -79.25 -32.41 43.77 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 122.618 0.367 . . . . 74.12 111.86 177.873 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 28.8 ttpp -80.27 -33.38 37.83 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.322 0.649 . . . . 75.34 112.279 -173.479 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 48.0 mtt180 -102.19 -59.93 1.62 Allowed 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.166 0.586 . . . . 73.53 111.77 179.508 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 164.15 173.34 32.7 Favored Glycine 0 CA--C 1.536 1.37 0 N-CA-C 114.66 0.624 . . . . 60.33 114.66 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -87.65 3.15 6.41 Favored 'Trans proline' 0 CA--C 1.557 1.65 0 C-N-CA 123.47 2.78 . . . . 64.43 114.147 -177.859 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 32.3 t -65.07 151.11 46.86 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 123.782 0.833 . . . . 62.11 112.16 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 89.9 p -65.48 -18.38 65.27 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.314 0.646 . . . . 64.04 111.812 176.444 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.425 ' HD2' ' N ' ' A' ' 37' ' ' LYS . 0.2 OUTLIER -77.83 -15.01 59.38 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.745 0.818 . . . . 65.43 111.936 175.859 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 90.0 m -77.63 -39.55 44.88 Favored 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 108.845 -0.798 . . . . 72.14 108.845 169.817 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -65.38 -30.25 71.05 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.045 0.938 . . . . 75.13 111.313 172.095 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.72 -35.84 65.15 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.454 0.702 . . . . 71.13 111.584 175.852 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 56.1 t80 -65.19 -42.39 93.65 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-O 121.47 0.653 . . . . 65.04 110.602 170.839 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.477 HD23 ' HD3' ' A' ' 45' ' ' LYS . 50.4 mt -64.94 -32.92 74.87 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.842 0.857 . . . . 64.31 111.543 175.638 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.7 -35.56 81.1 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.285 0.634 . . . . 61.44 111.535 174.083 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.71 -45.82 81.29 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.177 0.591 . . . . 60.44 112.07 177.368 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.477 ' HD3' HD23 ' A' ' 42' ' ' LEU . 18.0 ptmt -86.05 -22.99 26.93 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 112.938 0.718 . . . . 72.21 112.938 -174.282 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 92.3 mt -90.55 -10.66 42.67 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.217 0.607 . . . . 74.32 111.475 171.393 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.3 t70 64.7 36.62 8.09 Favored 'General case' 0 CA--C 1.567 1.608 0 C-N-CA 124.269 1.027 . . . . 61.43 111.525 176.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -133.23 -168.69 2.13 Favored 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 124.005 0.922 . . . . 71.51 111.996 -176.119 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -85.86 144.98 40.22 Favored Pre-proline 0 N--CA 1.492 1.642 0 C-N-CA 123.335 0.654 . . . . 72.43 111.334 175.669 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -61.33 -31.0 88.62 Favored 'Trans proline' 0 C--N 1.388 2.609 0 C-N-CA 122.911 2.407 . . . . 72.32 112.847 177.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -65.79 -37.13 85.47 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.062 0.945 . . . . 71.2 110.855 177.335 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.51 ' HB3' ' HZ2' ' A' ' 17' ' ' TRP . 75.2 mm-40 -75.5 -31.23 60.1 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.508 0.723 . . . . 71.0 112.187 179.193 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 94.8 t -63.32 -40.27 88.42 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 C-N-CA 122.827 0.451 . . . . 63.44 110.293 170.069 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 37.9 t -62.67 -39.46 94.01 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.387 0.675 . . . . 52.44 111.809 177.444 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -53.55 -53.75 47.15 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 121.315 0.579 . . . . 72.31 110.679 174.188 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 9.7 mmm180 -61.1 -41.69 97.14 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 114.634 -1.166 . . . . 72.5 112.919 -178.816 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 40.4 t80 -57.91 -51.12 70.94 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 124.029 0.932 . . . . 73.54 112.442 176.314 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 -74.64 -24.81 58.89 Favored 'General case' 0 CA--C 1.555 1.148 0 CA-C-N 115.775 -0.648 . . . . 74.12 111.744 -176.05 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.461 ' O ' ' HG ' ' A' ' 63' ' ' LEU . 16.0 mm100 -75.47 -29.29 59.57 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.09 0.556 . . . . 75.44 110.692 170.068 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.616 HD11 ' HA ' ' A' ' 22' ' ' ASP . 9.8 mt -66.04 -41.75 90.47 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.827 0.851 . . . . 62.32 111.9 175.693 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 25.3 mmt -69.07 -26.96 65.21 Favored 'General case' 0 N--CA 1.484 1.238 0 CA-C-O 121.198 0.523 . . . . 71.03 111.321 175.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.9 ttmp? -72.14 -40.08 68.3 Favored 'General case' 0 CA--C 1.561 1.371 0 C-N-CA 124.111 0.964 . . . . 65.12 111.038 172.303 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' A' ' 59' ' ' GLN . 95.9 mt -70.55 -30.97 67.83 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 123.585 0.754 . . . . 64.01 111.494 175.272 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -67.2 -40.27 86.44 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.735 0.814 . . . . 74.35 110.319 178.893 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -65.34 -39.01 91.86 Favored 'General case' 0 CA--C 1.555 1.157 0 C-N-CA 123.961 0.904 . . . . 74.22 111.232 172.279 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 45.8 mtpt 76.82 -29.36 0.17 Allowed 'General case' 0 N--CA 1.498 1.961 0 C-N-CA 126.129 1.772 . . . . 73.51 113.698 178.053 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 50.8 m -65.6 89.29 0.1 Allowed 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.665 0.786 . . . . 62.14 112.717 -173.127 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 10.4 tmtt? -74.77 83.23 2.13 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.93 0.892 . . . . 73.11 109.237 -179.356 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 39.0 t -105.01 -6.13 20.32 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.631 0.772 . . . . 61.14 111.764 -178.749 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 82.7 mtt180 . . . . . 0 C--O 1.254 1.317 0 C-N-CA 124.142 0.977 . . . . 74.33 110.634 176.982 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 41.9 t . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 120.272 0.082 . . . . 54.13 110.979 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 70.6 m80 -138.67 130.32 27.64 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 124.048 0.939 . . . . 45.4 110.007 178.881 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 52.3 ttm -159.38 93.85 1.14 Allowed 'General case' 0 N--CA 1.481 1.085 0 CA-C-O 121.156 0.503 . . . . 73.12 111.088 -179.328 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.6 mppt? -113.02 121.31 44.23 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 123.414 0.686 . . . . 62.43 109.34 172.454 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 24.8 p-10 -143.51 176.46 9.17 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.121 0.568 . . . . 74.31 112.139 -176.176 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 43.8 t 58.67 87.04 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.424 0 C-N-CA 125.074 1.35 . . . . 73.22 112.031 177.673 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 36.6 mm -93.08 -25.39 4.97 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.216 0 CA-C-N 115.41 -0.814 . . . . 70.41 110.721 -179.162 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 60.4 tttp -82.72 102.55 11.6 Favored 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 123.163 0.585 . . . . 72.34 110.207 174.66 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -99.05 143.36 29.41 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.838 0.855 . . . . 72.5 110.63 -178.842 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -90.63 46.8 1.36 Allowed 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 113.036 0.754 . . . . 74.2 113.036 -172.476 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 79.63 -8.68 47.4 Favored Glycine 0 CA--C 1.539 1.559 0 N-CA-C 115.62 1.008 . . . . 75.13 115.62 173.246 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -68.41 123.94 22.16 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-N 117.914 0.857 . . . . 74.23 109.416 177.329 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 28.7 mm 63.07 112.4 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.562 1.409 0 C-N-CA 125.226 1.41 . . . . 61.23 111.031 -166.815 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 2.4 mp -75.02 -29.71 22.46 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 C-N-CA 125.132 1.373 . . . . 60.31 111.054 -173.651 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 59.0 mt -66.21 137.92 23.98 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.272 0 C-N-CA 124.428 1.091 . . . . 63.21 111.87 -176.908 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 49.4 tp -73.47 85.92 1.53 Allowed 'General case' 0 CA--C 1.553 1.078 0 CA-C-O 121.44 0.638 . . . . 63.12 110.594 176.132 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -85.14 125.14 32.56 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 115.831 -0.622 . . . . 74.34 110.374 174.167 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' THR . . . . . 0.508 ' OG1' ' HB2' ' A' ' 21' ' ' ASP . 41.4 p -89.7 148.22 23.41 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 109.081 -0.711 . . . . 74.15 109.081 179.21 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -63.03 -20.09 64.99 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.28 0.632 . . . . 73.0 112.435 -172.44 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.461 ' O ' HG23 ' A' ' 24' ' ' VAL . 9.3 m120 -75.94 -47.09 26.55 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 123.507 0.723 . . . . 74.3 109.908 171.825 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.508 ' HB2' ' OG1' ' A' ' 18' ' ' THR . 0.4 OUTLIER -59.96 -55.79 29.76 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 125.208 1.403 . . . . 74.55 111.783 -173.563 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.565 ' HB2' HD21 ' A' ' 60' ' ' LEU . 1.6 p30 -64.49 -32.51 74.17 Favored 'General case' 0 CA--C 1.557 1.238 0 CA-C-N 115.735 -0.666 . . . . 73.43 112.573 179.786 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -64.58 -38.02 89.57 Favored 'General case' 0 CA--C 1.56 1.335 0 C-N-CA 123.011 0.524 . . . . 74.3 111.395 174.011 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.461 HG23 ' O ' ' A' ' 20' ' ' ASN . 99.1 t -67.69 -32.14 55.48 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 C-N-CA 123.182 0.593 . . . . 74.33 111.239 176.262 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 91.5 mt -56.6 -54.91 23.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 C-N-CA 122.238 0.215 . . . . 71.34 110.907 173.389 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.502 ' HG ' HD13 ' A' ' 60' ' ' LEU . 98.7 mt -57.8 -44.07 86.08 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 123.394 0.678 . . . . 71.1 111.757 176.184 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 39.5 tp -60.57 -49.46 77.46 Favored 'General case' 0 CA--C 1.561 1.397 0 C-N-CA 124.286 1.034 . . . . 62.52 112.452 -177.413 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -77.78 -20.35 53.47 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.575 0.75 . . . . 72.12 112.539 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 69.4 m -74.12 -29.27 61.75 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-O 120.846 0.355 . . . . 73.42 110.732 170.33 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 91.7 mt-30 -75.41 -19.58 59.43 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.215 0.606 . . . . 72.44 111.42 170.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 35.8 ttmt -82.88 -69.76 0.6 Allowed 'General case' 0 CA--C 1.559 1.302 0 C-N-CA 123.512 0.725 . . . . 75.23 111.407 173.471 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 51.6 mtp180 -81.07 -42.14 21.49 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.582 0.753 . . . . 74.43 112.699 -174.377 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 122.74 161.08 11.11 Favored Glycine 0 CA--C 1.54 1.609 0 CA-C-O 119.711 -0.494 . . . . 63.31 112.784 -175.335 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -69.27 92.66 0.47 Allowed 'Trans proline' 0 C--N 1.374 1.901 0 C-N-CA 122.608 2.206 . . . . 61.1 111.914 173.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 43.6 t -148.47 157.74 43.66 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 123.084 0.554 . . . . 61.02 112.287 -174.634 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 95.4 p -63.63 -29.54 70.77 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 123.569 0.747 . . . . 75.15 111.092 175.748 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -63.57 -34.88 78.78 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.772 0.829 . . . . 64.11 111.019 175.174 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 21.5 m -82.94 -33.32 26.78 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 115.249 -0.887 . . . . 71.11 110.054 -177.741 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -68.63 -38.17 80.29 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.372 0.669 . . . . 54.32 111.104 175.474 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.35 -35.3 75.74 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.378 0.671 . . . . 61.34 111.275 174.252 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -66.43 -47.71 72.33 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 123.522 0.729 . . . . 65.24 111.435 177.08 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.412 ' HB2' HG11 ' A' ' 53' ' ' VAL . 25.9 mt -69.17 -24.22 64.03 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.49 1.116 . . . . 73.54 111.986 176.347 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.51 -47.34 82.11 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-O 121.091 0.472 . . . . 73.32 110.601 170.005 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -68.09 -39.69 82.81 Favored 'General case' 0 CA--C 1.557 1.213 0 C-N-CA 123.588 0.755 . . . . 71.54 112.058 177.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 32.3 ttmt -73.94 -36.51 64.66 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 124.094 0.958 . . . . 52.44 112.223 -176.568 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 82.6 mt -108.27 9.56 27.94 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 112.882 0.697 . . . . 73.44 112.882 -174.202 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 66.71 11.73 8.38 Favored 'General case' 0 N--CA 1.503 2.194 0 C-N-CA 124.73 1.212 . . . . 64.55 112.944 -179.49 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm -91.65 -163.99 1.12 Allowed 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 124.068 0.947 . . . . 74.1 112.049 -175.484 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -124.81 149.75 63.64 Favored Pre-proline 0 CA--C 1.567 1.63 0 C-N-CA 124.087 0.955 . . . . 74.21 109.212 174.464 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -48.68 -44.22 31.68 Favored 'Trans proline' 0 C--N 1.391 2.769 0 C-N-CA 123.782 2.988 . . . . 71.53 115.755 -173.879 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -68.51 -35.22 77.18 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 122.51 0.324 . . . . 73.43 111.315 -179.279 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 -62.69 -45.97 90.34 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 123.345 0.658 . . . . 74.2 111.076 175.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.412 HG11 ' HB2' ' A' ' 42' ' ' LEU . 98.8 t -62.2 -40.7 88.6 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.04 0 CA-C-N 115.503 -0.771 . . . . 54.31 111.252 176.525 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.0 t -68.71 -45.13 72.38 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.902 0.881 . . . . 74.22 112.765 -175.711 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -64.88 -42.16 95.06 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 122.694 0.398 . . . . 73.15 110.878 178.518 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 22.3 tpt180 -66.39 -39.34 88.99 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 122.592 0.357 . . . . 70.51 110.785 177.736 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 34.4 t80 -51.24 -53.13 38.3 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 124.57 1.148 . . . . 73.22 112.371 178.796 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -73.66 -23.09 59.8 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 112.72 0.637 . . . . 74.34 112.72 -177.429 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -75.88 -26.0 56.65 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 123.208 0.603 . . . . 74.15 110.783 172.233 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.565 HD21 ' HB2' ' A' ' 22' ' ' ASP . 42.1 mt -74.6 -40.72 61.41 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.818 0.847 . . . . 75.23 110.98 171.587 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.543 ' HA ' ' HD2' ' A' ' 64' ' ' PHE . 84.0 mtp -70.99 -27.32 63.62 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.436 0.694 . . . . 62.33 111.202 176.54 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -57.19 -38.41 73.61 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.029 0.931 . . . . 60.51 110.846 169.41 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 78.3 mt -65.74 -39.21 90.88 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.272 0.629 . . . . 74.33 111.496 176.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.543 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 52.3 m-85 -66.99 -30.17 70.21 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 122.803 0.441 . . . . 62.43 111.762 175.714 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -71.04 -48.18 54.32 Favored 'General case' 0 CA--C 1.554 1.107 0 CA-C-O 120.844 0.354 . . . . 54.34 110.532 173.051 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -168.86 125.41 0.96 Allowed 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.649 0.78 . . . . 75.43 111.276 -177.59 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 70.7 m -108.13 137.46 46.08 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 123.622 0.769 . . . . 75.22 110.627 175.556 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -116.9 -165.12 1.03 Allowed 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.59 0.756 . . . . 72.21 111.944 179.092 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 47.5 t 67.33 81.97 0.19 Allowed 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 125.117 1.367 . . . . 74.45 110.623 -173.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.407 ' H ' ' HG3' ' A' ' 70' ' ' ARG . 5.3 ppt_? . . . . . 0 CA--C 1.569 1.684 0 C-N-CA 123.79 0.836 . . . . 74.4 112.545 -177.866 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 39.6 m . . . . . 0 N--CA 1.492 1.63 0 N-CA-C 110.532 -0.173 . . . . 73.13 110.532 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 40.7 t-80 -78.05 82.98 4.37 Favored 'General case' 0 N--CA 1.485 1.283 0 CA-C-O 121.236 0.541 . . . . 73.44 109.708 177.683 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 49.5 ttm -89.63 135.42 33.62 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.369 0.668 . . . . 74.24 111.002 -175.622 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -115.55 130.92 57.04 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.193 0.997 . . . . 63.22 109.279 173.482 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 34.4 t-20 -89.1 87.9 7.36 Favored 'General case' 0 CA--C 1.557 1.243 0 N-CA-C 109.39 -0.596 . . . . 63.32 109.39 177.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.1 p -67.97 -35.09 70.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 C-N-CA 123.285 0.634 . . . . 62.31 111.93 -177.369 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.505 HG13 ' H ' ' A' ' 9' ' ' LYS . 34.6 pt -77.32 -26.11 15.39 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.258 0 C-N-CA 123.425 0.69 . . . . 63.11 111.549 179.769 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt 60.51 32.46 20.48 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 124.906 1.282 . . . . 73.5 113.362 178.628 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.505 ' H ' HG13 ' A' ' 7' ' ' ILE . 1.2 mptm? -98.04 176.97 5.57 Favored 'General case' 0 CA--C 1.558 1.262 0 C-N-CA 123.864 0.866 . . . . 72.14 110.317 171.087 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 58.5 mttp 67.73 -72.18 0.1 Allowed 'General case' 0 N--CA 1.498 1.931 0 C-N-CA 125.175 1.39 . . . . 72.14 112.343 -178.024 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -69.66 87.66 0.28 Allowed Glycine 0 C--N 1.353 1.48 0 C-N-CA 122.976 0.322 . . . . 62.41 113.492 179.719 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -83.37 135.09 34.84 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.046 0.538 . . . . 73.2 111.044 -179.139 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 24.1 mm -79.21 -8.74 11.77 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.736 0 C-N-CA 124.03 0.932 . . . . 73.32 112.884 -168.444 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.609 HG23 HG12 ' A' ' 15' ' ' ILE . 11.2 tt -50.45 -34.45 11.81 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.162 0 CA-C-O 121.938 0.875 . . . . 73.14 112.053 176.425 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.609 HG12 HG23 ' A' ' 14' ' ' ILE . 4.6 pt -129.04 100.91 5.97 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 CA-C-N 114.654 -1.157 . . . . 62.43 109.759 178.188 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 41.8 tp -75.94 78.23 2.83 Favored 'General case' 0 CA--C 1.55 0.969 0 CA-C-O 121.709 0.766 . . . . 43.54 110.173 178.449 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' TRP . . . . . 0.446 ' CH2' ' HG3' ' A' ' 48' ' ' LYS . 99.0 m95 -80.67 123.63 28.33 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-N 114.926 -1.034 . . . . 71.53 110.04 169.866 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 21.7 p -111.72 164.28 13.21 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 108.551 -0.907 . . . . 53.42 108.551 174.907 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 27.3 ptt-85 -57.59 -19.84 28.49 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.305 0.642 . . . . 51.12 112.465 178.491 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.444 ' O ' HG23 ' A' ' 24' ' ' VAL . 28.0 m-80 -70.86 -49.31 47.44 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.45 0.7 . . . . 64.41 110.754 174.556 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -62.24 -57.05 12.86 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.676 0.79 . . . . 71.24 112.272 -176.812 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.462 ' HB2' HD11 ' A' ' 60' ' ' LEU . 2.2 p30 -64.68 -31.89 73.31 Favored 'General case' 0 CA--C 1.555 1.162 0 C-N-CA 123.335 0.654 . . . . 72.31 112.399 -176.285 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -62.75 -39.24 93.54 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.557 0.743 . . . . 74.4 111.821 174.955 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 20' ' ' ASN . 62.4 t -65.61 -38.45 82.37 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 C-N-CA 122.969 0.508 . . . . 62.43 110.577 174.437 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 70.5 mt -59.87 -47.16 92.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 CA-C-O 120.96 0.409 . . . . 71.41 110.951 174.641 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.44 HD11 HD22 ' A' ' 60' ' ' LEU . 88.9 mt -62.86 -36.81 84.5 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.201 1.0 . . . . 54.33 112.09 178.255 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 53.5 tp -67.71 -53.85 24.22 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.339 0.656 . . . . 73.14 111.289 178.711 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.51 ' HA ' ' HB3' ' A' ' 31' ' ' LYS . 8.2 mm-40 -71.12 -20.78 62.28 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.737 0.815 . . . . 74.04 112.426 -176.971 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 35.7 t -67.05 -30.97 71.18 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.091 0.557 . . . . 53.45 111.699 171.316 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 24.3 mm-40 -96.86 -23.69 16.24 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.0 0.52 . . . . 74.35 111.501 177.598 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.51 ' HB3' ' HA ' ' A' ' 28' ' ' GLU . 58.6 tptt -76.17 -58.01 3.53 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.896 0.879 . . . . 71.21 110.649 179.37 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -90.82 -60.27 1.96 Allowed 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.641 0.777 . . . . 74.24 109.818 176.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 148.15 178.94 23.72 Favored Glycine 0 CA--C 1.536 1.375 0 CA-C-N 115.11 -0.95 . . . . 65.12 112.285 -175.245 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -82.83 35.77 0.59 Allowed 'Trans proline' 0 CA--C 1.562 1.906 0 C-N-CA 123.21 2.606 . . . . 64.33 112.762 174.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 30.3 t -72.36 145.54 47.68 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.959 0.904 . . . . 44.42 111.455 -179.342 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 80.2 p -61.3 -31.93 71.77 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.317 0.647 . . . . 74.5 111.311 173.365 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.1 tmtm? -65.34 -33.68 76.55 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 124.406 1.082 . . . . 75.14 110.889 174.657 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 56.2 m -75.04 -38.99 61.27 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.344 0.658 . . . . 45.41 109.786 -179.116 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 28.1 m-85 -67.26 -32.48 73.53 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 123.527 0.731 . . . . 71.41 112.066 174.46 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.14 -34.68 66.23 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.598 0.759 . . . . 64.55 111.324 174.51 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -63.0 -48.81 77.22 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 123.587 0.755 . . . . 72.32 110.536 172.277 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.458 ' HB2' HG11 ' A' ' 53' ' ' VAL . 44.4 mt -64.94 -29.31 70.24 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 124.644 1.178 . . . . 75.03 112.226 177.415 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.76 -50.53 68.69 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.13 0.572 . . . . 55.52 110.993 171.557 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.1 -27.6 62.75 Favored 'General case' 0 CA--C 1.558 1.282 0 C-N-CA 123.16 0.584 . . . . 72.1 112.368 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.53 -51.76 11.08 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.809 0.844 . . . . 55.52 109.959 -178.593 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 63.5 mt -87.1 2.53 49.46 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.872 0.869 . . . . 63.04 111.897 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 62.29 24.02 14.26 Favored 'General case' 0 N--CA 1.497 1.913 0 C-N-CA 124.67 1.188 . . . . 71.31 113.035 178.546 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.446 ' HG3' ' CH2' ' A' ' 17' ' ' TRP . 72.2 mmtt -96.94 -167.62 1.58 Allowed 'General case' 0 CA--C 1.558 1.252 0 C-N-CA 124.948 1.299 . . . . 73.43 111.144 177.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 24.8 m-80 -105.81 144.55 29.12 Favored Pre-proline 0 N--CA 1.492 1.631 0 C-N-CA 123.683 0.793 . . . . 75.23 110.376 175.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -63.32 -29.8 72.9 Favored 'Trans proline' 0 C--N 1.384 2.417 0 C-N-CA 122.794 2.329 . . . . 63.04 113.037 -175.71 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -61.12 -49.69 76.23 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.014 0.926 . . . . 73.21 110.334 174.748 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.467 ' O ' ' HG2' ' A' ' 56' ' ' ARG . 25.4 mt-30 -55.4 -55.64 29.36 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 115.391 -0.822 . . . . 75.44 111.492 176.719 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.458 HG11 ' HB2' ' A' ' 42' ' ' LEU . 84.6 t -55.98 -45.79 80.3 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.305 0 C-N-CA 124.036 0.934 . . . . 43.31 112.468 -174.35 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 32.8 t -61.39 -43.84 98.18 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.377 0.671 . . . . 64.11 111.698 178.594 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -65.89 -44.93 83.8 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.352 0.661 . . . . 73.22 111.801 178.907 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.467 ' HG2' ' O ' ' A' ' 52' ' ' GLN . 2.4 mmp_? -65.71 -35.82 81.85 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 122.492 0.317 . . . . 74.12 111.094 -176.35 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.518 ' HA ' HD12 ' A' ' 60' ' ' LEU . 17.0 t80 -53.77 -49.86 67.3 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.959 0.904 . . . . 60.25 111.708 172.241 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -71.8 -25.0 61.82 Favored 'General case' 0 CA--C 1.552 1.034 0 CA-C-N 115.506 -0.77 . . . . 74.3 111.64 -176.608 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -76.29 -39.4 54.31 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.033 0.533 . . . . 70.03 110.527 173.017 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.518 HD12 ' HA ' ' A' ' 57' ' ' PHE . 16.3 mt -54.26 -46.34 72.61 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 124.712 1.205 . . . . 74.21 111.563 177.27 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 31.7 mmt -56.06 -44.65 79.08 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.77 0.828 . . . . 60.13 111.498 175.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -71.09 -29.36 65.19 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.641 0.776 . . . . 73.23 112.512 178.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 93.0 mt -70.13 -38.88 75.66 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.095 0.558 . . . . 72.1 111.319 177.19 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 30.3 m-85 -62.29 -24.67 67.43 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 122.639 0.376 . . . . 72.25 111.943 174.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -80.62 -59.91 2.51 Favored 'General case' 0 CA--C 1.556 1.179 0 C-N-CA 123.271 0.628 . . . . 74.34 110.693 174.235 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 8.5 mtmp? -158.79 -169.16 2.61 Favored 'General case' 0 N--CA 1.504 2.225 0 C-N-CA 125.142 1.377 . . . . 72.44 110.659 -173.456 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 23.0 t 67.53 16.4 9.92 Favored 'General case' 0 N--CA 1.502 2.15 0 N-CA-C 114.639 1.348 . . . . 62.41 114.639 164.741 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 35.1 mtmm -71.48 122.06 19.75 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 112.939 0.718 . . . . 72.54 112.939 179.451 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 84.6 m -135.56 120.65 18.82 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.433 1.093 . . . . 65.42 109.115 170.651 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.561 1.397 0 C-N-CA 123.645 0.778 . . . . 72.24 109.255 -178.861 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 78.8 p . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 120.821 0.343 . . . . 51.44 111.476 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 69.8 t60 -154.69 152.34 29.81 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.773 0.829 . . . . 71.42 110.504 177.616 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 24.5 mmt -74.09 156.97 36.87 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-O 121.362 0.601 . . . . 63.04 112.058 178.38 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.7 ttmp? -85.21 149.2 25.67 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 124.122 0.969 . . . . 72.43 113.069 -169.242 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 24.2 p-10 -79.68 143.28 34.75 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.323 0.649 . . . . 60.13 111.027 174.652 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 68.9 t -96.68 126.61 49.34 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 C-N-CA 123.177 0.591 . . . . 74.41 110.57 176.516 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.7 mp -72.06 106.96 2.68 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.087 0 N-CA-C 108.858 -0.793 . . . . 41.01 108.858 175.169 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.409 ' HD3' ' O ' ' A' ' 9' ' ' LYS . 14.2 tmtt? -68.25 -45.15 73.99 Favored 'General case' 0 CA--C 1.558 1.287 0 C-N-CA 123.687 0.795 . . . . 74.24 110.893 -176.263 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.409 ' O ' ' HD3' ' A' ' 8' ' ' LYS . 38.5 ttmt 63.69 167.84 0.15 Allowed 'General case' 0 N--CA 1.502 2.165 0 C-N-CA 124.725 1.21 . . . . 64.33 111.82 -178.6 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.405 ' N ' ' HG2' ' A' ' 9' ' ' LYS . 34.8 mtmt 68.25 108.8 0.05 OUTLIER 'General case' 0 N--CA 1.495 1.782 0 C-N-CA 124.15 0.98 . . . . 72.4 111.738 174.194 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -62.53 102.39 0.49 Allowed Glycine 0 CA--C 1.536 1.356 0 N-CA-C 114.96 0.744 . . . . 53.13 114.96 -172.245 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -101.63 158.82 15.82 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.734 0.813 . . . . 75.34 110.496 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.499 ' H ' HD12 ' A' ' 13' ' ' ILE . 2.6 mp -85.67 59.14 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 CA-C-O 122.736 1.255 . . . . 72.04 110.068 -174.89 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 45.8 pt -122.14 6.22 5.75 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 C-N-CA 125.435 1.494 . . . . 63.41 111.019 178.251 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 17.3 mm 69.33 111.42 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 C-N-CA 125.674 1.59 . . . . 61.14 110.508 -170.032 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.0 mp -78.84 70.67 5.22 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.959 0.904 . . . . 73.42 111.61 -173.58 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' TRP . . . . . 0.474 ' HZ2' ' HB3' ' A' ' 52' ' ' GLN . 96.7 m95 -68.42 126.91 31.09 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.531 0.732 . . . . 75.45 111.407 177.681 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 25.9 p -103.17 164.6 11.52 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 120.979 0.419 . . . . 75.5 111.111 177.322 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.46 ' HA ' ' HE ' ' A' ' 19' ' ' ARG . 0.4 OUTLIER -60.34 -21.89 62.6 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.965 0.906 . . . . 73.25 112.377 -177.715 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -74.97 -49.51 19.76 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 123.739 0.816 . . . . 61.43 110.902 176.852 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 59.9 m-20 -59.82 -53.32 59.32 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 123.471 0.708 . . . . 71.22 112.092 -175.709 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.601 ' HB2' HD21 ' A' ' 60' ' ' LEU . 2.9 p30 -62.66 -32.42 73.47 Favored 'General case' 0 CA--C 1.561 1.372 0 CA-C-N 115.371 -0.832 . . . . 61.11 112.216 -177.579 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 35.7 ttm180 -70.54 -40.39 73.44 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.764 0.825 . . . . 73.04 111.57 176.758 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 45.8 t -61.81 -39.6 84.01 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.344 0 C-N-CA 123.665 0.786 . . . . 74.41 111.22 175.693 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 90.8 mt -56.24 -53.96 33.41 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 C-N-CA 123.206 0.602 . . . . 64.43 111.219 174.306 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 96.5 mt -62.49 -46.85 86.57 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.267 0.627 . . . . 75.15 112.18 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 49.1 tp -61.89 -50.3 72.75 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.973 0.909 . . . . 71.53 112.145 -174.644 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.522 ' HB2' HD21 ' A' ' 42' ' ' LEU . 31.1 mt-10 -76.85 -18.27 58.47 Favored 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 112.757 0.651 . . . . 74.23 112.757 -179.01 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 61.9 m -70.02 -29.43 66.48 Favored 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 122.508 0.323 . . . . 63.44 111.108 165.39 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 -83.7 -20.58 33.25 Favored 'General case' 0 N--CA 1.492 1.626 0 C-N-CA 122.901 0.481 . . . . 74.45 111.984 174.054 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -74.05 -44.72 53.28 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 122.996 0.519 . . . . 73.21 110.422 171.818 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 73.9 mtp180 -108.83 -70.98 0.78 Allowed 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.641 0.776 . . . . 75.21 111.954 -173.202 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 155.62 147.57 4.76 Favored Glycine 0 CA--C 1.54 1.617 0 CA-C-O 119.059 -0.856 . . . . 34.12 112.197 -175.292 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -65.67 86.2 0.22 Allowed 'Trans proline' 0 C--N 1.378 2.116 0 C-N-CA 123.234 2.623 . . . . 71.25 112.622 175.482 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 29.3 t -130.26 155.36 46.42 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 124.023 0.929 . . . . 62.43 110.818 -177.544 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 81.9 p -66.89 -29.41 69.3 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.259 0.623 . . . . 65.5 111.671 176.74 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -68.26 -32.06 71.97 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.148 0.579 . . . . 72.54 110.849 172.258 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 66.8 m -79.79 -33.51 40.47 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.218 0.607 . . . . 70.31 109.604 -179.295 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -69.43 -32.77 71.94 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.396 0.678 . . . . 73.51 111.048 173.195 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.8 -35.2 72.43 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.533 0.733 . . . . 75.12 111.287 173.409 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -62.93 -50.57 70.3 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.478 0.711 . . . . 73.11 111.121 172.075 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.522 HD21 ' HB2' ' A' ' 28' ' ' GLU . 54.8 mt -66.44 -23.38 66.28 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 124.411 1.085 . . . . 60.13 111.894 178.697 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.12 -45.99 82.83 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.15 0.58 . . . . 65.11 111.166 169.412 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.1 -32.56 65.05 Favored 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 123.347 0.659 . . . . 71.35 111.953 176.728 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.45 ' HB3' ' HA ' ' A' ' 42' ' ' LEU . 23.8 tptp -76.92 -34.24 57.69 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.906 1.282 . . . . 73.03 111.677 -173.917 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 92.2 mt -102.82 -5.24 23.84 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 123.73 0.812 . . . . 65.32 112.14 175.861 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.3 t70 65.2 31.53 10.72 Favored 'General case' 0 CA--C 1.574 1.883 0 C-N-CA 124.583 1.153 . . . . 70.4 111.215 -178.162 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -110.03 -177.2 3.19 Favored 'General case' 0 N--CA 1.495 1.812 0 C-N-CA 124.53 1.132 . . . . 75.32 111.984 -178.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -85.98 140.98 35.13 Favored Pre-proline 0 N--CA 1.489 1.489 0 C-N-CA 123.293 0.637 . . . . 72.41 110.853 173.115 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -66.63 -24.68 47.84 Favored 'Trans proline' 0 C--N 1.38 2.222 0 C-N-CA 122.4 2.067 . . . . 44.24 113.039 -177.39 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -67.34 -47.05 71.64 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.522 0.729 . . . . 64.03 110.186 173.293 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.474 ' HB3' ' HZ2' ' A' ' 17' ' ' TRP . 84.2 mm-40 -60.62 -32.5 71.64 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.695 0.798 . . . . 55.22 112.081 177.112 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.479 HG11 ' HB2' ' A' ' 42' ' ' LEU . 88.8 t -74.95 -45.12 43.9 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.224 0 C-N-CA 123.859 0.864 . . . . 64.01 111.681 177.979 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 87.4 p -63.91 -42.51 97.38 Favored 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 123.1 0.56 . . . . 74.23 111.318 -179.639 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -60.61 -41.29 94.47 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.714 0.805 . . . . 73.5 111.432 172.419 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 1.2 tpp180 -64.16 -42.86 96.56 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 122.985 0.514 . . . . 74.33 111.736 -174.023 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -51.38 -48.65 62.48 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 124.002 0.921 . . . . 73.44 111.626 173.271 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -73.27 -32.52 64.71 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-N 115.551 -0.75 . . . . 75.24 112.301 -174.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.41 ' O ' ' HG ' ' A' ' 63' ' ' LEU . 17.6 mm-40 -70.94 -41.76 70.71 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.296 0.638 . . . . 74.21 110.479 175.24 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.601 HD21 ' HB2' ' A' ' 22' ' ' ASP . 7.5 mt -53.11 -44.11 67.38 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 124.908 1.283 . . . . 62.13 112.787 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 31.6 mmt -55.28 -43.47 74.78 Favored 'General case' 0 CA--C 1.558 1.288 0 O-C-N 123.962 0.789 . . . . 74.53 111.11 177.075 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -75.91 -29.8 58.54 Favored 'General case' 0 CA--C 1.558 1.279 0 C-N-CA 124.336 1.054 . . . . 72.34 112.623 178.113 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 59' ' ' GLN . 93.7 mt -71.06 -30.6 66.8 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 123.7 0.8 . . . . 70.15 112.281 -178.176 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 44.0 m-85 -57.09 -53.62 56.02 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 122.795 0.438 . . . . 62.42 110.934 174.418 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -73.77 -28.12 61.51 Favored 'General case' 0 CA--C 1.556 1.208 0 C-N-CA 123.134 0.574 . . . . 73.22 111.559 178.442 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 65.6 tttp 61.1 79.1 0.26 Allowed 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 124.84 1.256 . . . . 61.52 110.957 179.416 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 31.4 t -131.38 22.39 4.77 Favored 'General case' 0 N--CA 1.491 1.598 0 CA-C-N 115.393 -0.821 . . . . 74.45 111.453 -175.957 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -126.42 94.66 4.13 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.449 0.699 . . . . 72.14 111.467 -178.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 87.4 m -91.61 89.49 7.18 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.245 0.618 . . . . 34.51 109.672 170.66 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 26.1 tpt180 . . . . . 0 CA--C 1.564 1.513 0 CA-C-O 118.641 -0.695 . . . . 61.12 110.648 -179.402 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 41.1 t . . . . . 0 N--CA 1.486 1.356 0 N-CA-C 111.689 0.255 . . . . 71.11 111.689 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 30.1 m-70 63.0 12.98 6.31 Favored 'General case' 0 N--CA 1.498 1.973 0 C-N-CA 124.469 1.108 . . . . 74.23 113.034 -172.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 25.6 mmt -79.98 133.11 36.15 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 108.14 -1.059 . . . . 61.44 108.14 167.69 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -56.48 151.22 13.73 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.154 0.582 . . . . 70.11 112.245 -179.014 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -60.14 132.68 54.67 Favored 'General case' 0 N--CA 1.479 0.992 0 N-CA-C 108.873 -0.788 . . . . 64.45 108.873 170.356 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 64.7 t -53.46 102.41 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.831 0 C-N-CA 123.16 0.584 . . . . 73.42 112.151 -170.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 54.5 mt -83.09 121.7 36.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 C-N-CA 123.799 0.839 . . . . 72.45 110.086 -177.686 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 49.5 tptt -94.15 -57.11 2.61 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 122.941 0.496 . . . . 72.31 111.533 -176.939 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.2 tppt? 61.87 97.91 0.03 OUTLIER 'General case' 0 CA--C 1.561 1.39 0 C-N-CA 124.819 1.248 . . . . 64.42 112.027 -172.003 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -140.52 62.03 1.5 Allowed 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 124.601 1.16 . . . . 72.42 108.634 178.739 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -73.08 -64.72 2.46 Favored Glycine 0 C--N 1.35 1.347 0 CA-C-N 115.337 -0.847 . . . . 55.51 113.358 -175.517 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -96.37 169.53 9.86 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.243 0.617 . . . . 73.21 110.553 175.18 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.2 mp -93.02 130.88 41.45 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 C-N-CA 123.013 0.525 . . . . 72.34 110.375 -175.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 10.4 tt -147.02 76.76 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 C-N-CA 124.53 1.132 . . . . 55.23 108.51 173.173 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 27.1 mt 67.14 140.11 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 C-N-CA 124.93 1.292 . . . . 60.53 111.488 -176.157 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.9 mp -76.33 83.82 3.1 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-O 121.995 0.903 . . . . 71.21 111.289 -179.292 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 85.1 m95 -97.97 134.56 40.9 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.175 1.39 . . . . 71.25 109.869 174.333 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 24.8 p -98.47 156.61 16.69 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 109.293 -0.632 . . . . 52.22 109.293 176.06 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 6.3 ptm180 -58.47 -21.16 50.6 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 113.869 1.062 . . . . 73.44 113.869 -173.77 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.445 ' O ' HG23 ' A' ' 24' ' ' VAL . 66.8 t30 -74.32 -49.16 24.1 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 122.784 0.433 . . . . 73.13 110.403 176.582 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.6 -58.09 9.57 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.24 1.016 . . . . 74.23 113.287 -177.88 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.577 ' HB2' HD11 ' A' ' 60' ' ' LEU . 3.0 p30 -63.36 -31.73 72.97 Favored 'General case' 0 CA--C 1.56 1.342 0 C-N-CA 122.748 0.419 . . . . 63.23 111.914 -177.752 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 42.7 ttt-85 -64.97 -35.48 81.32 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 123.261 0.624 . . . . 72.24 111.541 174.862 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.445 HG23 ' O ' ' A' ' 20' ' ' ASN . 90.2 t -70.77 -33.77 53.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 C-N-CA 123.276 0.631 . . . . 44.33 111.017 174.783 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 95.0 mt -57.93 -46.99 87.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 CA-C-O 120.707 0.289 . . . . 71.5 110.419 172.503 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.638 HD21 ' HB3' ' A' ' 60' ' ' LEU . 96.1 mt -60.77 -38.5 85.48 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.845 0.858 . . . . 71.55 112.313 176.392 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 40.4 tp -68.9 -47.44 65.8 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.462 0.705 . . . . 71.24 111.733 -179.434 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -75.69 -23.59 56.19 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.301 0.64 . . . . 74.24 111.913 -179.19 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.455 ' SG ' ' HE1' ' A' ' 57' ' ' PHE . 34.7 t -64.76 -31.03 72.07 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.417 0.687 . . . . 74.24 111.284 171.816 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -88.58 -31.53 18.57 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.467 0.707 . . . . 73.11 111.648 176.222 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -78.63 -70.17 0.51 Allowed 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.0 0.52 . . . . 61.14 111.105 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 7.2 mpt_? -70.46 -28.62 65.15 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.688 0.795 . . . . 73.41 112.102 178.569 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.16 167.8 35.87 Favored Glycine 0 CA--C 1.536 1.348 0 CA-C-O 119.493 -0.615 . . . . 63.2 112.579 -175.491 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_exo -72.62 87.72 0.94 Allowed 'Trans proline' 0 C--N 1.373 1.841 0 C-N-CA 122.606 2.204 . . . . 65.54 111.956 175.022 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.8 t -135.56 158.36 44.59 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.356 0.662 . . . . 72.22 111.515 -177.509 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 64.4 p -63.65 -38.66 91.96 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.701 0.8 . . . . 74.14 111.863 177.647 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 57.8 pttt -73.55 -11.15 60.35 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 123.283 0.633 . . . . 70.42 112.382 177.253 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 56.6 m -78.36 -40.38 36.52 Favored 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 108.97 -0.752 . . . . 73.12 108.97 174.936 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 49.1 m-85 -65.91 -33.37 75.67 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.673 0.789 . . . . 73.13 111.145 173.506 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.82 -41.46 83.04 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.361 0.664 . . . . 62.13 111.39 174.672 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -62.07 -50.4 72.1 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 122.883 0.473 . . . . 75.02 110.59 173.725 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.402 ' HA ' ' HB3' ' A' ' 45' ' ' LYS . 59.4 mt -63.33 -23.71 67.54 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 124.84 1.256 . . . . 72.23 112.7 178.627 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ALA . . . . . 0.556 ' HA ' ' O ' ' A' ' 48' ' ' LYS . . . -65.59 -50.85 63.6 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.135 0.574 . . . . 73.15 111.45 173.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.79 -28.26 61.56 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-N 115.907 -0.588 . . . . 53.53 111.956 176.48 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.402 ' HB3' ' HA ' ' A' ' 42' ' ' LEU . 23.1 tptm -71.19 -47.38 57.84 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 124.403 1.081 . . . . 63.32 111.585 -176.46 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 75.7 mt -107.34 -0.22 22.6 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.754 0.822 . . . . 71.02 112.701 -172.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 62.0 33.57 17.2 Favored 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 124.571 1.148 . . . . 73.33 112.074 -176.612 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.556 ' O ' ' HA ' ' A' ' 43' ' ' ALA . 45.6 mmtm -126.48 116.22 20.78 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.811 0.845 . . . . 73.14 109.573 -178.878 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -48.3 148.43 3.26 Favored Pre-proline 0 N--CA 1.502 2.14 0 C-N-CA 123.691 0.797 . . . . 73.32 112.954 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -53.82 -31.67 63.07 Favored 'Trans proline' 0 C--N 1.387 2.557 0 C-N-CA 123.285 2.657 . . . . 74.51 115.041 -168.224 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 25.3 m-80 -63.62 -38.87 92.74 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 123.154 0.582 . . . . 74.34 111.511 178.651 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -62.41 -43.09 99.65 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.971 0.908 . . . . 75.31 110.229 178.21 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 57.6 t -68.81 -42.68 82.86 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.982 0 CA-C-N 114.261 -1.336 . . . . 75.33 111.716 -177.601 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 58.0 m -64.19 -36.36 83.79 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.996 0.918 . . . . 54.01 112.789 -177.05 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -63.58 -46.8 84.19 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 122.797 0.439 . . . . 72.32 111.084 175.063 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 17.2 mmt180 -70.67 -27.76 64.27 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 112.708 0.632 . . . . 75.32 112.708 178.227 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.455 ' HE1' ' SG ' ' A' ' 29' ' ' CYS . 22.8 t80 -56.38 -55.52 32.49 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.078 0.551 . . . . 72.54 110.735 175.162 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -71.69 -25.99 62.32 Favored 'General case' 0 CA--C 1.554 1.111 0 CA-C-N 115.232 -0.895 . . . . 70.1 111.637 -178.502 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -72.39 -38.87 68.36 Favored 'General case' 0 CA--C 1.556 1.19 0 C-N-CA 124.818 1.247 . . . . 74.32 109.684 179.198 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.638 ' HB3' HD21 ' A' ' 26' ' ' LEU . 44.3 mt -73.98 -37.43 64.48 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.758 1.223 . . . . 72.03 111.716 177.612 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 29.4 mmt -64.7 -28.1 69.37 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 122.909 0.484 . . . . 65.34 111.436 174.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 57.7 tttm -72.79 -41.97 64.42 Favored 'General case' 0 CA--C 1.557 1.223 0 C-N-CA 123.405 0.682 . . . . 73.24 110.791 175.103 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 93.0 mt -64.02 -32.81 74.49 Favored 'General case' 0 N--CA 1.497 1.89 0 C-N-CA 123.481 0.713 . . . . 72.11 111.246 173.125 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -61.83 -33.53 74.32 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.42 1.088 . . . . 75.02 110.972 179.532 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -72.27 -58.36 3.47 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 123.511 0.725 . . . . 64.31 109.718 169.802 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -178.21 150.15 0.57 Allowed 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 124.635 1.174 . . . . 75.22 109.466 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 69.4 m -70.06 -57.69 4.68 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 122.644 0.378 . . . . 75.24 111.974 -179.499 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 7.7 mtpm? 60.96 117.8 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.955 0 C-N-CA 125.044 1.338 . . . . 75.14 113.941 177.204 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 60.6 m -95.02 59.62 2.31 Favored 'General case' 0 N--CA 1.485 1.301 0 N-CA-C 109.238 -0.653 . . . . 72.51 109.238 169.73 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 59.8 mtt-85 . . . . . 0 CA--C 1.564 1.502 0 C-N-CA 125.018 1.327 . . . . 62.11 111.652 -168.272 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 64.4 p . . . . . 0 N--CA 1.49 1.545 0 CA-C-O 120.718 0.294 . . . . 71.11 110.805 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 74.5 t60 61.53 -86.27 0.02 OUTLIER 'General case' 0 CA--C 1.568 1.668 0 C-N-CA 124.822 1.249 . . . . 71.13 111.381 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 59.5 ttm -177.17 -66.27 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 124.57 1.148 . . . . 73.3 109.962 169.907 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 58.5 tttp 64.82 104.95 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.779 0 C-N-CA 124.76 1.224 . . . . 72.52 112.436 -178.489 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 34.6 t-20 -97.24 -67.1 0.86 Allowed 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 109.064 -0.717 . . . . 74.25 109.064 174.658 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 45.2 t 57.15 87.63 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.559 1.301 0 C-N-CA 124.958 1.303 . . . . 71.24 111.711 -174.216 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.7 mp -76.37 128.61 37.61 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 N-CA-C 109.075 -0.713 . . . . 72.51 109.075 174.662 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -81.41 131.88 35.3 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.179 0.592 . . . . 74.14 111.075 177.825 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LYS . . . . . 0.462 ' HE3' ' HA ' ' A' ' 9' ' ' LYS . 1.3 tpmt? -93.88 97.88 10.68 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.086 0.554 . . . . 72.21 110.473 176.42 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? -90.52 92.39 8.84 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 122.786 0.434 . . . . 72.12 110.248 178.072 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -81.09 -130.26 1.03 Allowed Glycine 0 CA--C 1.541 1.683 0 CA-C-N 116.332 -0.395 . . . . 72.21 112.258 174.273 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -74.04 141.49 45.76 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-N 117.055 0.427 . . . . 72.33 109.987 171.803 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.1 pp -63.99 92.51 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.559 1.323 0 CA-C-O 121.657 0.742 . . . . 74.3 111.466 177.231 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 41.9 pt -65.83 -11.81 13.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 C-N-CA 124.539 1.136 . . . . 64.21 111.884 173.702 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 2.7 mp -58.85 128.51 19.68 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.885 0 C-N-CA 125.04 1.336 . . . . 74.31 110.71 175.502 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.2 mt -72.81 87.23 1.28 Allowed 'General case' 0 CA--C 1.547 0.834 0 CA-C-O 121.47 0.652 . . . . 73.25 110.429 175.853 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 90.3 m95 -79.72 112.78 17.32 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 114.96 -1.018 . . . . 74.34 109.907 175.005 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 37.7 p -103.53 167.37 9.85 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.262 0.625 . . . . 62.41 111.597 -175.22 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.447 ' O ' ' HB2' ' A' ' 23' ' ' ARG . 16.5 ptm180 -62.28 -21.49 65.26 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-N 115.268 -0.878 . . . . 70.54 112.303 174.575 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -77.66 -45.21 25.67 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 123.721 0.808 . . . . 71.31 110.842 174.778 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.471 ' HA ' HD22 ' A' ' 46' ' ' LEU . 76.7 m-20 -60.26 -58.84 6.8 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.051 0.54 . . . . 62.24 112.079 -176.801 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -66.87 -30.73 70.97 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 123.498 0.719 . . . . 75.33 111.704 -172.559 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.447 ' HB2' ' O ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -60.77 -49.61 76.82 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.993 0.917 . . . . 72.32 111.448 175.814 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 89.2 t -69.95 -32.18 50.62 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 CA-C-N 114.587 -1.188 . . . . 74.41 110.889 -179.644 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.403 ' HA ' HD13 ' A' ' 42' ' ' LEU . 66.4 mt -56.3 -56.28 14.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 C-N-CA 122.491 0.317 . . . . 54.45 110.7 172.852 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 96.0 mt -58.08 -45.4 87.22 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.317 0.647 . . . . 74.53 112.472 179.58 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 32.2 tp -64.92 -50.05 67.99 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.094 0.557 . . . . 71.23 112.274 -174.774 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -78.41 -23.26 46.81 Favored 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 123.033 0.533 . . . . 74.52 112.42 -178.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.491 ' HA ' HG21 ' A' ' 38' ' ' THR . 53.3 t -73.04 -31.46 64.45 Favored 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 122.933 0.493 . . . . 73.11 111.549 177.26 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -87.08 7.4 28.04 Favored 'General case' 0 N--CA 1.486 1.363 0 CA-C-O 120.668 0.27 . . . . 54.12 111.259 173.537 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.8 ttmp? -110.03 -53.27 2.69 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 123.871 0.868 . . . . 73.51 111.233 -178.424 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -100.86 9.14 42.7 Favored 'General case' 0 N--CA 1.497 1.889 0 C-N-CA 123.583 0.753 . . . . 73.43 112.22 177.687 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 87.88 160.39 35.62 Favored Glycine 0 CA--C 1.544 1.881 0 CA-C-O 119.944 -0.365 . . . . 74.34 113.75 -178.606 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.439 ' HA ' ' SG ' ' A' ' 29' ' ' CYS . 53.2 Cg_endo -84.9 40.51 0.84 Allowed 'Trans proline' 0 C--N 1.37 1.687 0 C-N-CA 123.247 2.631 . . . . 61.21 113.691 -177.743 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 47.4 m -107.43 171.64 7.27 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 123.614 0.765 . . . . 51.22 112.384 -175.03 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 88.7 p -61.58 -24.27 66.55 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 123.789 0.835 . . . . 74.12 112.776 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -49.66 -45.27 48.41 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 124.471 1.108 . . . . 74.44 111.68 170.526 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.491 HG21 ' HA ' ' A' ' 29' ' ' CYS . 17.7 m -88.35 -33.97 17.77 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 114.806 -1.088 . . . . 74.35 110.9 -173.758 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 -67.79 -35.48 78.74 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.004 0.521 . . . . 75.25 112.251 -179.813 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.2 -36.43 69.19 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.387 0.613 . . . . 42.24 111.411 174.37 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 20.9 t80 -59.69 -49.43 77.77 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 124.236 1.014 . . . . 73.01 111.463 172.361 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.483 ' HB2' HG11 ' A' ' 53' ' ' VAL . 59.8 mt -70.52 -26.28 63.51 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 124.308 1.043 . . . . 72.21 112.008 178.698 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.1 -56.32 22.27 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 122.892 0.477 . . . . 74.31 111.327 174.723 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.57 -28.64 68.69 Favored 'General case' 0 N--CA 1.485 1.296 0 N-CA-C 112.363 0.505 . . . . 62.53 112.363 178.143 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.5 tptp -69.96 -45.79 66.65 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.114 0.565 . . . . 74.02 112.104 178.209 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.555 ' HB2' ' HG2' ' A' ' 48' ' ' LYS . 28.8 mt -99.09 0.94 44.67 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.26 0.624 . . . . 73.12 112.153 -173.605 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 25.8 t70 69.45 26.98 5.06 Favored 'General case' 0 CA--C 1.569 1.709 0 C-N-CA 125.115 1.366 . . . . 74.35 111.831 -178.71 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.555 ' HG2' ' HB2' ' A' ' 46' ' ' LEU . 63.2 mmtt -101.8 -174.89 2.7 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 123.682 0.793 . . . . 45.44 111.458 179.258 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 -100.13 151.35 37.49 Favored Pre-proline 0 N--CA 1.49 1.557 0 C-N-CA 123.821 0.848 . . . . 71.22 109.285 167.909 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -61.83 -33.53 84.58 Favored 'Trans proline' 0 C--N 1.382 2.306 0 C-N-CA 122.721 2.281 . . . . 74.05 113.35 -176.102 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 -65.99 -39.19 90.1 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.666 0.786 . . . . 70.33 111.538 177.437 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -69.42 -38.72 78.02 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.489 0.716 . . . . 74.4 111.339 -179.738 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.483 HG11 ' HB2' ' A' ' 42' ' ' LEU . 95.0 t -65.42 -41.42 91.07 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 C-N-CA 123.436 0.694 . . . . 60.53 110.872 174.382 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.8 t -60.05 -42.33 94.23 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.563 0.745 . . . . 53.23 111.311 176.491 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -64.81 -49.6 70.01 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 115.837 -0.619 . . . . 75.22 111.547 175.024 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.47 ' O ' ' HB2' ' A' ' 60' ' ' LEU . 3.3 tpm_? -57.21 -41.98 80.43 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 122.998 0.519 . . . . 73.23 111.912 -178.002 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -59.07 -54.92 41.58 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.983 0.913 . . . . 72.33 112.24 177.441 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -73.35 -28.9 62.3 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.012 0.525 . . . . 74.45 111.95 -173.302 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.51 ' O ' ' HG ' ' A' ' 63' ' ' LEU . 56.5 mt-30 -64.72 -46.14 83.55 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 122.947 0.499 . . . . 71.51 110.003 167.011 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.47 ' HB2' ' O ' ' A' ' 56' ' ' ARG . 0.8 OUTLIER -60.38 -38.35 83.66 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 124.256 1.022 . . . . 71.33 111.238 -177.6 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 21.7 mmt -72.63 -30.26 64.16 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.276 0.631 . . . . 55.14 111.869 176.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 53.0 tptt -73.77 -32.74 63.94 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 123.114 0.566 . . . . 73.4 111.105 174.591 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 59' ' ' GLN . 80.4 mt -71.96 -42.16 66.9 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.84 0.856 . . . . 74.51 110.5 175.544 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 53.0 t80 -68.72 -26.47 65.28 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 124.494 1.118 . . . . 72.44 110.649 176.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -71.4 -59.19 2.89 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 123.607 0.763 . . . . 72.01 110.69 175.337 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -159.67 122.78 3.57 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.493 0.717 . . . . 71.04 110.417 -177.757 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 53.7 m 69.3 107.92 0.06 Allowed 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 125.171 1.389 . . . . 52.14 112.432 176.777 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.459 ' HA ' ' HB3' ' A' ' 63' ' ' LEU . 97.2 mttt -86.4 153.44 21.91 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.592 0.757 . . . . 70.03 112.017 178.033 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 46.2 t -84.43 128.93 34.87 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.165 0.586 . . . . 44.13 111.767 -177.123 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 36.0 ttt180 . . . . . 0 CA--C 1.568 1.665 0 C-N-CA 123.599 0.76 . . . . 72.13 111.698 175.157 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 90.3 p . . . . . 0 N--CA 1.49 1.575 0 CA-C-O 120.733 0.301 . . . . 54.41 111.3 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 61.7 m-70 -91.83 51.57 1.86 Allowed 'General case' 0 N--CA 1.49 1.565 0 CA-C-O 121.641 0.734 . . . . 73.12 109.921 178.126 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 26.1 ttt -73.78 113.13 10.57 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 124.527 1.131 . . . . 62.44 112.053 -168.674 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -112.46 94.0 4.71 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 124.073 0.949 . . . . 64.21 110.764 177.566 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -82.75 110.44 17.79 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.145 0.578 . . . . 72.31 110.57 177.904 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 43.8 t -72.66 86.64 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.116 0 CA-C-O 121.729 0.776 . . . . 52.13 109.889 179.379 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 11.2 tt -98.46 104.74 16.34 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.178 0 CA-C-N 115.244 -0.889 . . . . 74.31 111.161 -175.245 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 50.3 mtmt -123.46 62.71 1.03 Allowed 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.865 0.866 . . . . 75.25 109.126 174.847 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -84.87 -20.08 31.37 Favored 'General case' 0 N--CA 1.485 1.284 0 CA-C-N 115.189 -0.914 . . . . 74.25 111.7 178.523 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -155.72 125.97 6.68 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.892 0.877 . . . . 64.14 109.686 -174.407 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -75.07 77.2 1.17 Allowed Glycine 0 C--N 1.348 1.244 0 O-C-N 123.378 0.424 . . . . 60.51 113.331 179.663 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -107.12 154.48 21.1 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.731 0.813 . . . . 73.11 109.905 177.462 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.6 mp -73.91 -31.57 31.17 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 C-N-CA 123.393 0.677 . . . . 32.32 111.386 -174.813 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 61.2 mt 63.18 80.8 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.064 0 C-N-CA 124.712 1.205 . . . . 75.23 109.64 -171.325 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.629 HD13 ' HA ' ' A' ' 52' ' ' GLN . 52.4 mt 64.01 106.02 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 125.239 1.416 . . . . 75.21 111.587 -176.207 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 48.2 tp -73.36 113.31 10.3 Favored 'General case' 0 CA--C 1.551 1.018 0 CA-C-O 121.282 0.563 . . . . 64.31 112.283 -173.812 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' TRP . . . . . 0.549 ' HE1' ' HG3' ' A' ' 56' ' ' ARG . 98.6 m95 -126.2 173.97 8.86 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.715 1.206 . . . . 62.42 110.434 171.502 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 14.0 p -103.8 160.91 14.38 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 108.382 -0.97 . . . . 61.25 108.382 164.744 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 36.7 ptt-85 -57.0 -26.05 59.58 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 123.309 0.644 . . . . 73.31 111.886 177.352 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.438 ' O ' HG23 ' A' ' 24' ' ' VAL . 22.3 m-80 -75.52 -37.25 60.21 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.016 0.927 . . . . 75.45 110.911 -179.888 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -68.37 -47.71 66.68 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 112.961 0.726 . . . . 64.22 112.961 -177.487 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -65.54 -30.36 71.1 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 120.872 0.368 . . . . 72.03 111.38 176.829 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -62.32 -44.29 96.84 Favored 'General case' 0 N--CA 1.484 1.226 0 CA-C-N 116.421 -0.354 . . . . 73.04 111.053 168.717 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 20' ' ' ASN . 68.1 t -63.17 -34.28 65.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 C-N-CA 123.351 0.66 . . . . 74.03 111.169 176.676 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 88.0 mt -61.32 -44.03 97.7 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.502 0 C-N-CA 122.581 0.353 . . . . 72.23 111.222 173.762 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.442 ' HG ' HD13 ' A' ' 60' ' ' LEU . 94.0 mt -72.19 -28.53 63.26 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.609 0.764 . . . . 72.14 112.537 174.644 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 47.5 tp -68.01 -52.01 40.53 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 124.211 1.004 . . . . 53.52 110.325 178.86 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -76.97 -16.21 59.41 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 114.922 -1.035 . . . . 64.43 112.018 178.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 46.1 t -60.61 -32.85 71.97 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 123.076 0.55 . . . . 74.43 111.842 167.131 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 9.6 mm100 -91.14 -18.21 24.86 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 122.686 0.394 . . . . 75.01 110.973 176.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.403 ' HG3' ' NH1' ' A' ' 32' ' ' ARG . 54.1 tptt -74.67 -34.15 62.62 Favored 'General case' 0 CA--C 1.559 1.307 0 C-N-CA 124.09 0.956 . . . . 74.01 110.801 174.15 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.403 ' NH1' ' HG3' ' A' ' 31' ' ' LYS . 2.8 mpt_? -126.14 -73.77 0.62 Allowed 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.81 0.844 . . . . 74.13 110.561 174.859 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 150.37 167.33 14.31 Favored Glycine 0 N--CA 1.479 1.566 0 CA-C-O 119.056 -0.858 . . . . 52.22 111.574 -172.062 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.27 74.89 2.46 Favored 'Trans proline' 0 CA--C 1.564 1.991 0 CA-C-N 120.49 2.145 . . . . 72.41 112.363 173.138 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 42.5 t -123.38 164.18 19.36 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 124.302 1.041 . . . . 74.52 111.671 -173.211 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 79.8 p -62.94 -40.62 98.22 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 124.391 1.076 . . . . 64.25 111.621 179.531 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -66.25 -25.76 67.04 Favored 'General case' 0 N--CA 1.485 1.315 0 CA-C-N 115.541 -0.754 . . . . 62.44 112.072 176.075 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 20.8 m -83.87 -32.24 25.3 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.388 0.675 . . . . 74.51 110.394 -177.092 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -61.23 -40.22 93.2 Favored 'General case' 0 CA--C 1.555 1.156 0 C-N-CA 122.84 0.456 . . . . 74.22 110.304 170.374 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.71 -34.72 62.66 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.04 0.936 . . . . 73.3 111.957 177.479 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -64.84 -46.26 82.65 Favored 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 124.19 0.996 . . . . 73.54 110.989 177.19 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.476 ' HB2' HG11 ' A' ' 53' ' ' VAL . 42.7 mt -73.61 -25.61 60.41 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.417 1.087 . . . . 53.41 112.259 175.42 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.91 -42.64 94.56 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-O 120.872 0.368 . . . . 72.12 110.576 171.027 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -71.07 -36.93 72.45 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.682 0.793 . . . . 51.42 112.133 176.73 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 9.0 tmtm? -77.1 -41.62 41.37 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.908 0.883 . . . . 53.21 111.583 -174.257 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.434 ' HB3' ' HZ3' ' A' ' 17' ' ' TRP . 83.8 mt -99.6 -1.6 37.74 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.482 0.713 . . . . 53.34 112.02 -176.328 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 36.7 t70 55.58 65.2 1.53 Allowed 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 124.868 1.267 . . . . 73.42 112.815 179.43 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.44 ' HG3' ' CH2' ' A' ' 17' ' ' TRP . 68.1 mmtt -141.48 175.86 9.34 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 124.864 1.265 . . . . 51.24 109.922 172.643 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 65.2 m-80 -75.23 149.59 84.72 Favored Pre-proline 0 CA--C 1.559 1.291 0 N-CA-C 110.158 -0.312 . . . . 74.11 110.158 168.733 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -54.86 -29.66 64.39 Favored 'Trans proline' 0 C--N 1.387 2.571 0 C-N-CA 122.998 2.465 . . . . 64.1 114.482 -178.256 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -65.16 -41.02 95.08 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 123.612 0.765 . . . . 74.22 111.561 176.539 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.629 ' HA ' HD13 ' A' ' 15' ' ' ILE . 76.7 mm-40 -64.89 -36.79 85.51 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.427 0.691 . . . . 72.43 111.179 -176.878 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.476 HG11 ' HB2' ' A' ' 42' ' ' LEU . 82.4 t -72.51 -50.78 32.51 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.951 0 CA-C-N 115.161 -0.927 . . . . 71.1 111.045 172.391 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 46.6 t -60.16 -49.47 77.49 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 124.388 1.075 . . . . 62.52 112.884 -169.963 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.45 ' O ' ' HG2' ' A' ' 59' ' ' GLN . 31.4 mm-40 -56.51 -47.71 78.76 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.412 0.685 . . . . 62.05 111.833 177.703 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.549 ' HG3' ' HE1' ' A' ' 17' ' ' TRP . 10.1 mmm180 -71.91 -28.15 63.29 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.731 0.812 . . . . 74.2 112.843 -179.125 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -66.87 -41.29 87.51 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 108.716 -0.846 . . . . 65.55 108.716 173.302 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.407 ' O ' ' HG3' ' A' ' 62' ' ' LYS . 53.4 mt-30 -69.33 -29.65 67.53 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 115.356 -0.838 . . . . 72.24 111.642 175.826 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.45 ' HG2' ' O ' ' A' ' 55' ' ' GLU . 13.3 mm100 -66.99 -41.58 86.5 Favored 'General case' 0 N--CA 1.49 1.57 0 CA-C-O 121.203 0.525 . . . . 72.14 109.832 176.071 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.442 HD13 ' HG ' ' A' ' 26' ' ' LEU . 69.2 mt -59.57 -43.76 93.5 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 114.989 -1.005 . . . . 74.44 111.059 174.225 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 23.6 mmt -65.78 -29.89 70.45 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.266 0.626 . . . . 64.32 112.325 176.828 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.407 ' HG3' ' O ' ' A' ' 58' ' ' GLN . 95.9 mttt -70.39 -31.91 69.33 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.392 0.677 . . . . 74.13 111.094 173.396 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 85.6 mt -67.6 -39.6 84.78 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.024 0.529 . . . . 70.23 111.082 174.381 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -72.92 -31.18 64.46 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 123.129 0.572 . . . . 63.24 111.861 174.435 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -60.3 -58.43 8.55 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.654 0.781 . . . . 73.41 111.094 -179.411 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.68 -45.01 22.33 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 122.748 0.419 . . . . 74.11 110.078 -179.834 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 23.2 t 65.75 27.48 11.19 Favored 'General case' 0 N--CA 1.497 1.917 0 C-N-CA 124.352 1.061 . . . . 71.24 111.571 -176.771 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -74.36 90.76 2.16 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-O 121.167 0.508 . . . . 75.43 109.885 176.067 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 66.0 m -86.58 87.67 7.49 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-O 121.273 0.559 . . . . 64.35 110.316 179.545 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ARG . . . . . 0.41 ' HG3' ' H ' ' A' ' 70' ' ' ARG . 0.3 OUTLIER . . . . . 0 CA--C 1.574 1.899 0 C-N-CA 124.201 1.0 . . . . 74.23 113.085 -178.442 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 45.0 t . . . . . 0 N--CA 1.491 1.59 0 N-CA-C 110.888 -0.041 . . . . 63.35 110.888 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 77.9 m-70 -70.75 112.29 6.85 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 122.908 0.483 . . . . 64.35 111.356 177.114 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 27.3 ttt -163.64 -65.38 0.04 OUTLIER 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.048 0.939 . . . . 72.33 109.532 176.365 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 61.17 98.76 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 124.637 1.175 . . . . 72.43 112.626 176.402 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -70.02 -31.67 69.45 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 122.87 0.468 . . . . 53.14 110.844 173.056 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 98.2 t 60.65 98.68 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 C-N-CA 124.935 1.294 . . . . 72.14 113.029 174.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 9.9 tt -70.85 -52.33 28.9 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.25 0 N-CA-C 109.571 -0.529 . . . . 73.04 109.571 167.062 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.1 mtpt -144.99 160.93 40.56 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 125.059 1.344 . . . . 71.42 109.116 176.593 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -160.27 -40.08 0.05 Allowed 'General case' 0 N--CA 1.496 1.835 0 CA-C-N 118.25 0.477 . . . . 73.13 112.266 -173.269 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.84 150.71 44.2 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 113.277 0.843 . . . . 62.32 113.277 -172.235 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 137.66 175.22 13.74 Favored Glycine 0 N--CA 1.475 1.26 0 CA-C-N 115.533 -0.758 . . . . 55.34 112.75 -174.345 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 -90.14 93.44 9.37 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 122.868 0.467 . . . . 73.22 111.421 178.318 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.3 mp -77.49 127.72 38.22 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 N-CA-C 108.234 -1.024 . . . . 72.34 108.234 171.639 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.1 mp -78.49 85.06 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.871 0 N-CA-C 108.565 -0.902 . . . . 50.43 108.565 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.61 HG13 ' HG2' ' A' ' 52' ' ' GLN . 48.5 mm 72.81 142.9 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.564 1.519 0 C-N-CA 125.414 1.486 . . . . 74.32 112.987 176.378 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -70.89 84.28 0.67 Allowed 'General case' 0 CA--C 1.559 1.31 0 C-N-CA 124.43 1.092 . . . . 74.03 110.262 -178.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 80.8 m95 -98.12 115.06 27.5 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.462 0.705 . . . . 74.23 111.434 179.479 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 58.2 p -107.58 166.11 10.92 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.333 0.653 . . . . 44.52 110.949 177.282 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 17.1 ptp180 -57.91 -21.16 42.09 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 124.198 0.999 . . . . 72.11 112.276 174.015 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -76.58 -46.04 27.86 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 124.084 0.954 . . . . 60.03 110.724 174.658 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 39.2 m-20 -59.7 -57.03 14.67 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.25 0.62 . . . . 75.22 111.735 178.685 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.629 ' HB2' HD21 ' A' ' 60' ' ' LEU . 2.6 p30 -64.97 -31.74 73.13 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 113.209 0.818 . . . . 73.3 113.209 -174.916 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 48.2 ttt180 -62.28 -42.11 99.06 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 122.893 0.477 . . . . 73.52 111.018 175.922 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.463 ' HB ' HD21 ' A' ' 46' ' ' LEU . 92.7 t -71.36 -33.09 48.95 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 C-N-CA 123.455 0.702 . . . . 72.11 111.487 177.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 94.5 mt -57.65 -57.38 10.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 CA-C-O 120.886 0.374 . . . . 64.31 110.278 172.402 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.436 ' HG ' HD13 ' A' ' 60' ' ' LEU . 90.6 mt -61.89 -33.28 73.94 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 115.636 -0.711 . . . . 71.21 112.174 178.656 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 56.0 tp -61.76 -54.46 42.08 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.803 0.841 . . . . 71.32 111.533 179.047 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.524 ' HA ' ' HB3' ' A' ' 31' ' ' LYS . 59.3 mm-40 -75.13 -22.94 57.85 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 113.045 0.757 . . . . 75.23 113.045 -178.679 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 89.6 m -69.83 -30.13 67.56 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 122.775 0.43 . . . . 54.11 111.307 171.782 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -91.92 -20.38 21.47 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.346 0.658 . . . . 71.25 111.882 173.87 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.524 ' HB3' ' HA ' ' A' ' 28' ' ' GLU . 58.8 tptt -80.66 -67.21 0.79 Allowed 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.641 0.777 . . . . 73.1 110.545 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 45.2 mtt85 -92.51 -40.38 10.85 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.03 0.932 . . . . 72.03 111.74 -178.34 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 138.48 163.07 9.43 Favored Glycine 0 N--CA 1.481 1.658 0 CA-C-O 119.528 -0.596 . . . . 52.14 112.556 -178.384 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -83.2 36.37 0.61 Allowed 'Trans proline' 0 CA--C 1.561 1.858 0 C-N-CA 123.017 2.478 . . . . 71.04 113.815 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 79.1 p -80.59 161.44 24.73 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.589 0.756 . . . . 75.24 111.732 -177.745 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 99.0 p -67.05 -23.77 65.91 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.04 0.536 . . . . 72.11 111.587 174.745 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -69.8 -32.04 70.28 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.531 0.732 . . . . 65.13 111.492 173.725 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 86.3 m -78.04 -37.17 47.45 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.048 0.539 . . . . 72.31 109.636 178.228 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -64.7 -32.08 73.59 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.405 0.682 . . . . 73.42 111.39 172.588 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.62 -39.51 88.36 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 123.415 0.686 . . . . 74.33 111.26 173.527 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -63.05 -49.16 75.67 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.264 0.625 . . . . 72.2 110.797 172.087 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 77.9 mt -63.62 -23.76 67.52 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 124.79 1.236 . . . . 65.11 113.032 -179.652 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.75 -55.03 34.52 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 123.088 0.555 . . . . 45.5 110.998 170.295 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.67 -27.83 62.34 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.586 0.754 . . . . 64.04 112.351 179.223 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -75.91 -39.02 57.1 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.184 0.993 . . . . 71.32 111.325 -177.109 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.463 HD21 ' HB ' ' A' ' 24' ' ' VAL . 91.0 mt -106.26 12.75 29.66 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.759 0.824 . . . . 72.54 112.687 -177.312 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.0 p30 51.37 23.95 1.95 Allowed 'General case' 0 N--CA 1.501 2.117 0 C-N-CA 125.548 1.539 . . . . 75.41 114.09 -174.743 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -106.82 -175.01 2.67 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 123.615 0.766 . . . . 71.42 111.565 -178.221 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 47.5 m-80 -96.55 143.84 26.82 Favored Pre-proline 0 N--CA 1.492 1.628 0 C-N-CA 123.084 0.554 . . . . 74.14 110.431 173.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -66.24 -26.74 48.96 Favored 'Trans proline' 0 C--N 1.379 2.137 0 C-N-CA 122.653 2.235 . . . . 42.24 113.512 -171.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -71.76 -38.77 70.33 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.46 0.704 . . . . 74.32 111.32 178.264 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.61 ' HG2' HG13 ' A' ' 15' ' ' ILE . 12.0 mp0 -70.75 -35.14 72.5 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.174 0.59 . . . . 73.34 110.849 176.742 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 86.1 t -62.4 -47.36 93.37 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 C-N-CA 123.375 0.67 . . . . 61.51 111.26 174.475 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 90.9 p -65.67 -41.7 92.18 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.35 0.66 . . . . 74.11 112.161 -177.239 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -64.92 -48.97 72.25 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 122.675 0.39 . . . . 72.42 111.63 177.018 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.46 ' NH1' ' HB3' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -70.08 -23.98 63.16 Favored 'General case' 0 CA--C 1.561 1.368 0 C-N-CA 123.313 0.645 . . . . 72.53 111.215 -177.079 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.484 ' HA ' HD12 ' A' ' 60' ' ' LEU . 23.9 t80 -61.13 -49.29 77.86 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 123.979 0.912 . . . . 75.1 111.556 170.71 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -73.88 -24.42 59.73 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 115.465 -0.789 . . . . 71.1 111.143 -178.801 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLN . . . . . 0.408 ' O ' ' HG ' ' A' ' 63' ' ' LEU . 83.8 mm-40 -72.35 -32.81 66.79 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.58 0.752 . . . . 75.24 111.102 171.509 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.629 HD21 ' HB2' ' A' ' 22' ' ' ASP . 15.3 mt -58.58 -55.54 33.79 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.415 0.686 . . . . 72.3 111.142 173.218 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 27.9 mmt -63.4 -31.06 72.12 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.015 0.526 . . . . 72.03 112.018 178.844 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -64.01 -46.37 84.82 Favored 'General case' 0 CA--C 1.556 1.209 0 C-N-CA 123.498 0.719 . . . . 64.43 111.389 174.418 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 59' ' ' GLN . 97.3 mt -72.02 -41.12 67.91 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.496 0.718 . . . . 65.31 112.09 -179.115 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -67.96 -16.2 63.95 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 123.367 0.667 . . . . 70.44 112.631 -179.294 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -66.49 -33.6 76.05 Favored 'General case' 0 CA--C 1.561 1.397 0 C-N-CA 122.484 0.314 . . . . 64.14 111.09 170.43 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 64.4 pttt -114.21 7.68 16.63 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 112.685 0.624 . . . . 73.42 112.685 178.611 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 58.6 m -74.98 128.55 35.83 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 122.025 -0.422 . . . . 64.25 110.896 175.716 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 90.9 mttt -74.55 104.86 5.41 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.573 0.749 . . . . 64.14 110.562 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 76.6 m -79.02 16.66 0.88 Allowed 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 123.906 0.883 . . . . 64.43 113.234 -176.098 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 55.2 ttt180 . . . . . 0 CA--C 1.558 1.287 0 C-N-CA 123.944 0.898 . . . . 73.02 109.323 176.461 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 90.9 m95 . . . . . 0 N--CA 1.487 1.421 0 N-CA-C 110.389 -0.226 . . . . 74.310000000000002 110.389 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 44.8 p -126.16 169.44 12.83 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.117 0.567 . . . . 65.019999999999996 111.201 179.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -51.9 -33.11 35.45 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 124.831 1.252 . . . . 74.319999999999993 114.063 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.405 ' O ' HG23 ' A' ' 24' ' ' VAL . 14.6 t-20 -73.52 -34.73 65.38 Favored 'General case' 0 CA--C 1.558 1.267 0 C-N-CA 123.094 0.558 . . . . 71.439999999999998 111.244 -176.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -69.71 -52.38 26.07 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.307 0.643 . . . . 73.010000000000005 112.013 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -58.83 -31.63 68.65 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.852 0.861 . . . . 64.530000000000001 112.549 -178.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 74.4 ttt180 -62.59 -46.2 89.41 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 122.29 0.236 . . . . 71.420000000000002 111.068 174.145 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 20' ' ' ASN . 36.8 t -63.37 -39.15 84.21 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 C-N-CA 123.253 0.621 . . . . 74.400000000000006 111.092 -179.087 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.417 ' HA ' HD13 ' A' ' 42' ' ' LEU . 87.0 mt -54.81 -57.79 5.79 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.238 0 C-N-CA 123.225 0.61 . . . . 73.129999999999995 110.95 175.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 94.2 mt -63.05 -34.07 76.79 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.399 0.68 . . . . 55.210000000000001 112.142 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 31.7 tp -65.01 -53.39 46.9 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.428 0.691 . . . . 75.430000000000007 111.626 -177.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 48.1 mm-40 -75.76 -24.63 56.08 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 122.846 0.458 . . . . 74.120000000000005 112.2 179.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 41.5 t -68.94 -38.5 79.51 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 122.677 0.391 . . . . 64.409999999999997 111.364 177.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -80.75 -35.18 33.67 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.232 0.613 . . . . 73.349999999999994 111.203 177.184 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -64.28 -47.15 80.64 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 123.531 0.732 . . . . 71.409999999999997 111.852 177.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 36.8 mtt180 -104.6 -68.21 0.86 Allowed 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.649 0.78 . . . . 72.010000000000005 110.719 -173.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 145.81 135.51 2.81 Favored Glycine 0 CA--C 1.534 1.227 0 CA-C-O 118.885 -0.953 . . . . 74.329999999999998 110.912 -172.024 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -66.76 87.75 0.29 Allowed 'Trans proline' 0 CA--C 1.561 1.872 0 C-N-CA 122.716 2.278 . . . . 72.230000000000004 113.342 -178.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 98.7 p -126.55 163.45 23.38 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.128 0.971 . . . . 71.519999999999996 110.149 178.312 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 68.8 p -55.15 -39.82 69.9 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 123.953 0.901 . . . . 71.230000000000004 113.027 -179.39 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 63.7 pttt -73.76 -25.98 60.42 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.496 0.718 . . . . 73.519999999999996 112.335 179.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 86.4 m -76.1 -39.56 54.98 Favored 'General case' 0 N--CA 1.484 1.24 0 N-CA-C 108.87 -0.789 . . . . 52.020000000000003 108.87 175.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -67.16 -28.83 68.45 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 115.322 -0.854 . . . . 72.25 111.254 173.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.09 -35.95 66.71 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.749 0.82 . . . . 65.319999999999993 111.863 175.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -62.71 -50.37 71.39 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.184 0.594 . . . . 72.310000000000002 110.406 171.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.439 ' HB2' HG11 ' A' ' 53' ' ' VAL . 76.3 mt -66.21 -25.64 67.02 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.555 1.142 . . . . 70.040000000000006 112.192 177.229 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.39 -58.48 5.2 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.315 0.646 . . . . 64.030000000000001 111.117 175.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.84 -36.15 76.23 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 123.5 0.72 . . . . 51.409999999999997 111.945 178.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.25 -49.75 70.67 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 124.175 0.99 . . . . 74.099999999999994 111.81 176.217 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 52.3 mt -99.5 14.6 29.32 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 113.196 0.813 . . . . 65.310000000000002 113.196 -170.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 68.25 13.96 9.14 Favored 'General case' 0 N--CA 1.508 2.434 0 C-N-CA 125.071 1.349 . . . . 74.010000000000005 113.211 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -103.48 -176.72 3.16 Favored 'General case' 0 N--CA 1.483 1.182 0 CA-C-O 121.768 0.794 . . . . 52.420000000000002 112.843 -173.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -102.76 153.91 37.88 Favored Pre-proline 0 CA--C 1.559 1.296 0 CA-C-N 115.003 -0.999 . . . . 52.420000000000002 109.421 166.484 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_exo -47.11 -35.12 18.7 Favored 'Trans proline' 0 C--N 1.388 2.645 0 C-N-CA 123.623 2.882 . . . . 73.430000000000007 114.631 177.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.41 ' O ' ' HG3' ' A' ' 55' ' ' GLU . 78.8 m-20 -59.63 -50.55 73.42 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.613 0.765 . . . . 75.5 111.585 176.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 83.1 mm-40 -55.83 -46.43 78.13 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 123.56 0.744 . . . . 74.219999999999999 112.111 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.439 HG11 ' HB2' ' A' ' 42' ' ' LEU . 76.8 t -64.74 -45.78 94.14 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 CA-C-N 115.163 -0.926 . . . . 60.25 111.631 -178.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.3 t -59.47 -44.13 93.08 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.303 0.641 . . . . 62.32 111.941 179.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.418 ' O ' ' HG2' ' A' ' 59' ' ' GLN . 60.0 mt-10 -57.78 -50.82 71.97 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.127 0.571 . . . . 73.430000000000007 111.435 177.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 40.3 mmt-85 -68.78 -35.2 76.75 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 122.677 0.391 . . . . 74.230000000000004 111.908 -176.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -52.77 -52.77 55.25 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.422 0.689 . . . . 54.240000000000002 110.964 170.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -69.61 -25.14 63.81 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 115.337 -0.847 . . . . 44.420000000000002 112.133 -176.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.418 ' HG2' ' O ' ' A' ' 55' ' ' GLU . 30.9 mm-40 -68.56 -54.42 16.74 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 109.373 -0.602 . . . . 61.100000000000001 109.373 172.406 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 21.0 mt -47.61 -48.02 28.53 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 125.02 1.328 . . . . 63.409999999999997 112.607 179.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 23.7 mmt . . . . . 0 N--CA 1.487 1.423 0 C-N-CA 123.297 0.639 . . . . 72.430000000000007 111.667 178.064 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 97.3 m95 . . . . . 0 N--CA 1.484 1.254 0 N-CA-C 110.195 -0.298 . . . . 74.340000000000003 110.195 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 30.7 p -135.38 168.57 18.97 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 124.137 0.975 . . . . 60.109999999999999 110.448 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 14.5 ptm180 -57.9 -28.33 64.12 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 113.976 1.102 . . . . 73.510000000000005 113.976 -171.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -68.82 -34.53 75.66 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.263 0.625 . . . . 65.239999999999995 111.463 178.002 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.418 ' HA ' HD22 ' A' ' 46' ' ' LEU . 47.8 m-20 -66.48 -57.7 6.79 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.003 0.521 . . . . 74.450000000000003 110.718 175.218 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -54.26 -39.01 66.46 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.506 1.122 . . . . 73.109999999999999 112.781 -179.471 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 61.3 ttt-85 -60.1 -50.33 74.13 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.191 0.597 . . . . 75.340000000000003 111.938 178.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 38.4 t -75.0 -31.71 25.63 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 122.708 0.403 . . . . 63.399999999999999 111.048 -174.154 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 75.1 mt -60.84 -48.57 88.32 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 C-N-CA 122.146 0.178 . . . . 65.5 110.621 172.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 96.3 mt -66.62 -34.8 78.67 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 123.186 0.594 . . . . 72.420000000000002 112.317 177.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 64.2 tp -61.87 -48.08 82.13 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.66 0.784 . . . . 74.200000000000003 111.298 177.657 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.55 ' HB3' HG23 ' A' ' 38' ' ' THR . 26.4 mm-40 -72.56 -32.42 66.04 Favored 'General case' 0 CA--C 1.551 0.988 0 CA-C-N 114.767 -1.106 . . . . 73.25 112.088 176.284 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.667 ' HG ' ' HE1' ' A' ' 57' ' ' PHE . 13.9 t -65.45 -35.46 80.98 Favored 'General case' 0 N--CA 1.491 1.598 0 C-N-CA 123.714 0.805 . . . . 73.319999999999993 112.212 179.478 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -90.39 -3.95 57.37 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.057 0.543 . . . . 55.329999999999998 111.963 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 27.0 tptp -113.15 -73.3 0.67 Allowed 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 123.123 0.569 . . . . 71.230000000000004 110.74 178.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 61.5 mtt180 -81.21 -10.61 59.58 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.257 0.623 . . . . 64.409999999999997 112.435 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 82.21 -165.22 44.8 Favored Glycine 0 CA--C 1.538 1.529 0 N-CA-C 114.611 0.604 . . . . 52.210000000000001 114.611 173.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -82.39 35.78 0.59 Allowed 'Trans proline' 0 C--N 1.374 1.906 0 C-N-CA 123.54 2.827 . . . . 60.229999999999997 113.557 176.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 65.4 m -76.34 152.66 36.29 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.166 0.586 . . . . 65.150000000000006 112.182 -177.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 87.5 p -63.7 -30.09 71.23 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 123.252 0.621 . . . . 73.400000000000006 110.462 168.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -55.37 -40.04 70.83 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 124.417 1.087 . . . . 63.200000000000003 110.977 170.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.55 HG23 ' HB3' ' A' ' 28' ' ' GLU . 32.2 m -75.76 -47.32 26.41 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 114.827 -1.079 . . . . 51.520000000000003 109.414 -174.248 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 21.1 m-85 -63.71 -30.43 71.53 Favored 'General case' 0 CA--C 1.551 0.997 0 CA-C-N 114.802 -1.09 . . . . 74.519999999999996 112.042 178.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.79 -42.57 77.16 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.421 0.688 . . . . 71.239999999999995 111.341 175.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -61.28 -55.75 28.38 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 122.791 0.436 . . . . 62.43 110.522 174.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.402 ' HB2' HG11 ' A' ' 53' ' ' VAL . 72.8 mt -61.47 -25.65 67.38 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.486 1.115 . . . . 60.43 113.107 -178.173 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.47 -56.13 18.6 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-O 121.153 0.502 . . . . 55.020000000000003 111.231 173.085 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -71.66 -30.63 65.94 Favored 'General case' 0 N--CA 1.482 1.174 0 CA-C-N 116.014 -0.539 . . . . 62.409999999999997 112.213 -178.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 8.5 tmtm? -73.91 -53.78 9.4 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.988 0.915 . . . . 75.120000000000005 110.659 -176.36 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.418 HD22 ' HA ' ' A' ' 21' ' ' ASP . 88.3 mt -86.73 3.06 46.48 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.262 0.625 . . . . 71.530000000000001 112.67 -175.667 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.0 t70 60.5 34.21 20.44 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-O 122.372 1.082 . . . . 61.340000000000003 110.666 -175.336 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 47.5 mmtm -107.17 -177.86 3.48 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 115.0 -1.0 . . . . 64.120000000000005 111.291 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.492 HD22 ' N ' ' A' ' 49' ' ' ASN . 0.7 OUTLIER -105.37 148.28 36.03 Favored Pre-proline 0 CA--C 1.554 1.131 0 N-CA-C 108.84 -0.8 . . . . 72.319999999999993 108.84 172.445 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_exo -53.4 -34.95 73.53 Favored 'Trans proline' 0 C--N 1.384 2.441 0 C-N-CA 122.746 2.297 . . . . 74.430000000000007 114.329 178.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 23.8 m120 -68.06 -44.72 75.69 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.654 0.382 . . . . 72.219999999999999 111.267 174.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.454 ' HG3' ' HB2' ' A' ' 49' ' ' ASN . 96.5 mt-30 -57.75 -45.4 85.93 Favored 'General case' 0 N--CA 1.494 1.73 0 C-N-CA 123.037 0.535 . . . . 54.219999999999999 111.393 176.25 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.402 HG11 ' HB2' ' A' ' 42' ' ' LEU . 87.9 t -63.83 -50.88 75.7 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.896 0 C-N-CA 123.717 0.807 . . . . 71.120000000000005 111.628 -179.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.447 ' O ' ' HG3' ' A' ' 58' ' ' GLN . 90.2 p -60.78 -43.41 98.13 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.185 0.594 . . . . 54.130000000000003 112.21 -176.313 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.437 ' O ' ' HG2' ' A' ' 59' ' ' GLN . 44.0 mt-10 -67.05 -43.66 82.16 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.148 0.579 . . . . 71.439999999999998 111.871 178.427 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 22.1 tpt180 -62.9 -39.95 96.1 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 123.137 0.575 . . . . 74.230000000000004 111.396 177.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.667 ' HE1' ' HG ' ' A' ' 29' ' ' CYS . 3.5 t80 -52.37 -48.3 65.67 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.547 1.139 . . . . 74.420000000000002 111.045 172.365 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.447 ' HG3' ' O ' ' A' ' 54' ' ' SER . 49.6 mt-30 -66.74 -34.51 78.0 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 115.851 -0.613 . . . . 74.120000000000005 111.532 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.437 ' HG2' ' O ' ' A' ' 55' ' ' GLU . 11.7 mm-40 -69.96 -33.36 71.99 Favored 'General case' 0 N--CA 1.486 1.345 0 CA-C-O 120.893 0.378 . . . . 72.140000000000001 110.579 177.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 32.8 mt -62.38 -41.91 99.0 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.059 0.944 . . . . 74.209999999999994 111.331 170.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 34.5 mmt . . . . . 0 N--CA 1.489 1.482 0 C-N-CA 123.388 0.675 . . . . 74.400000000000006 111.057 175.02 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 79.3 m95 . . . . . 0 N--CA 1.478 0.934 0 N-CA-C 109.851 -0.426 . . . . 74.409999999999997 109.851 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 19.4 p -108.48 168.29 9.43 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 122.245 -0.284 . . . . 74.409999999999997 110.684 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 24.1 ptt-85 -53.85 -21.78 8.38 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 124.401 1.081 . . . . 65.329999999999998 112.912 176.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.402 ' O ' HG23 ' A' ' 24' ' ' VAL . 22.8 m-80 -74.14 -49.6 23.04 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.359 0.664 . . . . 74.200000000000003 110.329 175.289 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -60.29 -58.95 6.34 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.895 0.878 . . . . 71.019999999999996 111.768 -178.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.612 ' HB2' HD21 ' A' ' 60' ' ' LEU . 2.1 p30 -66.2 -31.67 72.63 Favored 'General case' 0 CA--C 1.558 1.282 0 N-CA-C 113.268 0.84 . . . . 74.420000000000002 113.268 -172.492 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 34.9 ttt180 -60.23 -44.06 95.52 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 123.487 0.715 . . . . 73.310000000000002 111.64 173.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.402 HG23 ' O ' ' A' ' 20' ' ' ASN . 80.3 t -66.52 -37.61 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 C-N-CA 123.225 0.61 . . . . 44.439999999999998 111.201 177.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 78.1 mt -58.13 -56.2 17.45 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 122.749 0.42 . . . . 71.25 111.151 176.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.584 ' HG ' HD13 ' A' ' 60' ' ' LEU . 78.5 mt -57.99 -37.32 74.02 Favored 'General case' 0 N--CA 1.484 1.231 0 N-CA-C 112.322 0.49 . . . . 55.310000000000002 112.322 179.148 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 46.4 tp -63.65 -51.56 64.63 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.591 0.756 . . . . 74.340000000000003 112.447 -178.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -77.97 -22.24 49.72 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 112.679 0.622 . . . . 74.530000000000001 112.679 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 80.3 m -75.35 -41.66 56.05 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 112.215 0.45 . . . . 74.319999999999993 112.215 177.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -70.14 -29.25 66.13 Favored 'General case' 0 N--CA 1.491 1.625 0 C-N-CA 122.711 0.404 . . . . 60.420000000000002 111.204 175.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -73.98 -66.9 0.66 Allowed 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 124.045 0.938 . . . . 63.210000000000001 111.212 177.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 60.7 mtt-85 -80.41 -56.85 3.9 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.193 0.997 . . . . 73.239999999999995 111.328 -171.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 129.71 154.78 8.23 Favored Glycine 0 CA--C 1.538 1.523 0 CA-C-O 119.356 -0.691 . . . . 72.319999999999993 112.499 -177.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_exo -65.46 94.3 0.25 Allowed 'Trans proline' 0 C--N 1.377 2.042 0 C-N-CA 123.27 2.647 . . . . 74.430000000000007 112.684 176.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 67.3 m -142.24 155.64 45.26 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 124.07 0.948 . . . . 74.129999999999995 110.587 -178.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 91.2 p -59.92 -40.31 88.43 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 123.319 0.647 . . . . 63.420000000000002 112.411 -176.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 38.6 mtmm -68.37 -24.41 64.79 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.041 0.537 . . . . 73.140000000000001 112.337 176.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 68.5 m -78.19 -43.05 29.59 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 109.225 -0.657 . . . . 64.319999999999993 109.225 -179.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -72.07 -29.19 63.89 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 115.267 -0.879 . . . . 72.430000000000007 111.563 176.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.15 -34.72 61.65 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.518 0.727 . . . . 74.019999999999996 111.329 174.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 86.2 t80 -63.91 -48.53 76.25 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 122.995 0.518 . . . . 71.230000000000004 110.392 172.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.445 ' HB2' HG11 ' A' ' 53' ' ' VAL . 81.7 mt -66.36 -27.28 67.76 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.26 1.024 . . . . 70.519999999999996 112.109 176.255 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.83 -42.32 86.02 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.074 0.55 . . . . 54.229999999999997 111.207 172.36 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.42 -34.88 68.17 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.157 0.583 . . . . 61.310000000000002 111.478 175.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 58.8 tptt -67.21 -40.25 86.41 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.843 1.257 . . . . 71.200000000000003 111.358 -179.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 46.8 mt -109.26 12.23 24.96 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.807 0.843 . . . . 73.120000000000005 112.263 -175.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.7 p30 49.49 22.77 0.78 Allowed 'General case' 0 N--CA 1.51 2.527 0 C-N-CA 126.327 1.851 . . . . 74.340000000000003 114.75 -175.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 44.9 mmtm -99.67 -172.17 2.2 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.838 0.855 . . . . 63.310000000000002 111.319 179.388 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 -98.71 145.57 30.15 Favored Pre-proline 0 N--CA 1.489 1.512 0 C-N-CA 123.495 0.718 . . . . 73.25 110.52 176.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_exo -57.76 -32.73 95.54 Favored 'Trans proline' 0 C--N 1.387 2.558 0 C-N-CA 123.293 2.662 . . . . 54.549999999999997 113.839 -178.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -61.46 -48.93 78.89 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.998 0.919 . . . . 65.5 111.25 174.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -63.3 -41.35 98.95 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.822 0.849 . . . . 75.420000000000002 111.396 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.445 HG11 ' HB2' ' A' ' 42' ' ' LEU . 93.9 t -65.49 -42.99 94.51 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 C-N-CA 123.878 0.871 . . . . 35.109999999999999 111.441 177.787 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 37.8 t -64.2 -44.14 92.88 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.69 0.796 . . . . 51.329999999999998 111.904 -178.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.409 ' O ' ' HG3' ' A' ' 59' ' ' GLN . 47.4 mt-10 -65.97 -42.7 89.58 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.229 0.612 . . . . 62.240000000000002 111.327 174.431 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.433 ' HE ' ' HB3' ' A' ' 22' ' ' ASP . 32.2 tpt180 -60.86 -41.76 96.53 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.284 0.633 . . . . 72.030000000000001 111.414 -179.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -53.08 -48.27 67.88 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 124.247 1.019 . . . . 64.349999999999994 111.385 173.062 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -75.17 -24.67 57.92 Favored 'General case' 0 CA--C 1.555 1.145 0 CA-C-N 115.168 -0.923 . . . . 72.310000000000002 112.315 -178.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' A' ' 55' ' ' GLU . 98.0 mt-30 -68.36 -45.03 73.9 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 109.448 -0.575 . . . . 70.430000000000007 109.448 171.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.612 HD21 ' HB2' ' A' ' 22' ' ' ASP . 31.6 mt -56.01 -56.37 21.58 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.381 1.072 . . . . 72.439999999999998 111.75 175.464 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 17.2 mmt . . . . . 0 N--CA 1.481 1.095 0 N-CA-C 112.696 0.628 . . . . 54.140000000000001 112.696 -178.102 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . 0.441 ' HH2' HG22 ' A' ' 53' ' ' VAL . 90.8 m95 . . . . . 0 CA--C 1.551 0.99 0 N-CA-C 110.545 -0.169 . . . . 75.349999999999994 110.545 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 44.5 p -116.89 169.82 9.09 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 123.092 0.557 . . . . 64.209999999999994 110.222 176.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 16.7 ptt180 -57.81 -20.84 38.58 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 112.32 0.489 . . . . 72.239999999999995 112.32 177.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.434 ' O ' HG23 ' A' ' 24' ' ' VAL . 27.2 m-80 -70.19 -50.63 38.22 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.227 0.611 . . . . 73.209999999999994 110.391 175.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.459 ' HA ' HD22 ' A' ' 46' ' ' LEU . 16.5 m-20 -65.12 -54.8 24.36 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.239 0.616 . . . . 62.520000000000003 111.068 -179.712 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.603 ' HB3' HD21 ' A' ' 60' ' ' LEU . 1.2 m-20 -54.76 -39.38 68.27 Favored 'General case' 0 CA--C 1.559 1.295 0 C-N-CA 124.915 1.286 . . . . 72.400000000000006 113.223 -179.384 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 17.5 tpt180 -65.2 -44.81 87.14 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 122.512 0.325 . . . . 74.420000000000002 111.484 177.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 20' ' ' ASN . 57.7 t -67.69 -31.02 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 C-N-CA 122.787 0.435 . . . . 73.510000000000005 112.086 -176.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 87.9 mt -55.02 -56.41 11.14 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.417 0 CA-C-O 120.826 0.346 . . . . 51.020000000000003 110.432 169.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.41 HD11 ' HB3' ' A' ' 60' ' ' LEU . 68.2 mt -65.22 -28.87 69.67 Favored 'General case' 0 CA--C 1.556 1.209 0 C-N-CA 123.314 0.645 . . . . 75.299999999999997 112.198 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 61.1 tp -69.11 -48.81 61.55 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.432 0.693 . . . . 63.509999999999998 111.518 177.165 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.434 ' HA ' ' HB3' ' A' ' 31' ' ' LYS . 11.2 mm-40 -76.81 -19.19 57.84 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.115 0.566 . . . . 73.430000000000007 112.436 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 98.6 m -74.62 -33.25 62.53 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 112.104 0.409 . . . . 63.340000000000003 112.104 174.303 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -85.37 -24.04 27.74 Favored 'General case' 0 N--CA 1.493 1.712 0 C-N-CA 122.481 0.313 . . . . 73.129999999999995 111.413 172.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.434 ' HB3' ' HA ' ' A' ' 28' ' ' GLU . 60.6 tptt -84.26 -71.57 0.51 Allowed 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.721 0.808 . . . . 75.230000000000004 110.953 179.196 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.465 ' HD3' HG23 ' A' ' 38' ' ' THR . 39.9 ttt180 -79.11 -42.52 26.1 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 124.489 1.115 . . . . 73.430000000000007 111.824 -176.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 125.62 147.66 7.02 Favored Glycine 0 CA--C 1.54 1.6 0 CA-C-O 119.317 -0.713 . . . . 42.299999999999997 112.849 179.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -73.75 107.48 2.42 Favored 'Trans proline' 0 C--N 1.378 2.085 0 C-N-CA 123.114 2.543 . . . . 75.010000000000005 112.118 178.696 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 48.5 t -156.1 151.24 26.5 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.419 0.688 . . . . 54.200000000000003 110.814 -178.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 64.7 p -64.13 -27.79 69.33 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 122.928 0.491 . . . . 75.430000000000007 111.32 175.167 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 40.4 tttm -72.83 -21.66 60.92 Favored 'General case' 0 CA--C 1.561 1.376 0 C-N-CA 123.986 0.914 . . . . 73.140000000000001 110.665 175.569 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.465 HG23 ' HD3' ' A' ' 32' ' ' ARG . 81.5 m -86.96 -34.37 19.34 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 124.318 1.047 . . . . 74.439999999999998 110.015 173.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.444 ' HD1' HD12 ' A' ' 42' ' ' LEU . 21.5 m-85 -71.38 -28.34 63.97 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.434 0.694 . . . . 75.120000000000005 111.836 -179.868 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.482 ' HA ' ' HG3' ' A' ' 50' ' ' PRO . . . -67.98 -32.34 72.69 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.252 0.621 . . . . 63.009999999999998 111.44 170.477 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 50.2 t80 -76.05 -38.47 57.1 Favored 'General case' 0 CA--C 1.558 1.279 0 C-N-CA 123.596 0.758 . . . . 63.130000000000003 111.291 175.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.492 HD23 ' HD2' ' A' ' 45' ' ' LYS . 68.7 mt -66.31 -29.34 69.53 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.969 0.908 . . . . 75.420000000000002 111.263 173.335 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.57 -45.07 88.62 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 123.268 0.627 . . . . 63.109999999999999 111.203 171.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.07 -53.58 56.09 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 123.661 0.784 . . . . 73.219999999999999 112.585 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.583 ' HG3' ' HG ' ' A' ' 46' ' ' LEU . 0.2 OUTLIER -71.0 -40.23 71.94 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 112.889 0.7 . . . . 54.149999999999999 112.889 -175.844 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.583 ' HG ' ' HG3' ' A' ' 45' ' ' LYS . 81.6 mt -92.87 14.15 18.32 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 112.964 0.727 . . . . 74.430000000000007 112.964 -174.56 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.1 p30 51.2 22.45 1.34 Allowed 'General case' 0 N--CA 1.503 2.206 0 C-N-CA 125.951 1.7 . . . . 41.299999999999997 114.562 -176.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.409 ' HG2' ' O ' ' A' ' 46' ' ' LEU . 47.6 mmtm -101.72 -166.34 1.29 Allowed 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.948 0.899 . . . . 73.420000000000002 111.229 -179.587 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -127.45 146.62 59.01 Favored Pre-proline 0 CA--C 1.564 1.481 0 C-N-CA 123.259 0.624 . . . . 75.120000000000005 110.248 -179.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.482 ' HG3' ' HA ' ' A' ' 40' ' ' ALA . 59.3 Cg_exo -52.45 -38.81 74.85 Favored 'Trans proline' 0 C--N 1.389 2.668 0 C-N-CA 124.037 3.158 . . . . 74.310000000000002 115.71 -170.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 46.6 t-20 -59.28 -44.83 92.44 Favored 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 123.306 0.643 . . . . 62.039999999999999 110.713 177.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 36.9 mt-30 -67.0 -43.07 83.86 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.938 0.895 . . . . 71.129999999999995 110.777 -177.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.441 HG22 ' HH2' ' A' ' 17' ' ' TRP . 52.9 t -65.19 -45.81 92.77 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 CA-C-N 115.152 -0.931 . . . . 75.400000000000006 111.761 -178.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 80.8 p -64.3 -40.4 95.88 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.516 0.727 . . . . 70.120000000000005 111.724 -177.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -63.6 -49.59 72.74 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 116.043 -0.526 . . . . 62.200000000000003 111.176 172.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 10.9 tpt85 -60.83 -37.53 82.34 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 115.858 -0.61 . . . . 74.230000000000004 111.466 -174.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 29.1 t80 -53.13 -53.65 47.37 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 124.529 1.132 . . . . 70.319999999999993 112.881 176.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -73.82 -24.58 59.81 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 122.906 0.482 . . . . 62.32 111.968 -175.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 82.7 mm-40 -69.97 -42.71 72.78 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.121 0.568 . . . . 64.319999999999993 109.795 170.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.603 HD21 ' HB3' ' A' ' 22' ' ' ASP . 17.7 mt -61.71 -51.99 66.1 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.736 1.214 . . . . 53.119999999999997 112.542 -178.232 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 5.7 mmt . . . . . 0 N--CA 1.485 1.32 0 N-CA-C 112.244 0.461 . . . . 73.439999999999998 112.244 179.907 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 86.4 m95 . . . . . 0 N--CA 1.489 1.506 0 N-CA-C 110.547 -0.168 . . . . 74.329999999999998 110.547 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 25.1 p -119.98 159.1 25.39 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.93 0.892 . . . . 61.43 110.259 177.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 8.7 ptp85 -64.29 -20.75 66.29 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 123.704 0.802 . . . . 64.439999999999998 112.205 174.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -67.7 -44.88 76.69 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.933 0.893 . . . . 73.540000000000006 110.312 173.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -59.48 -44.95 92.92 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 123.495 0.718 . . . . 74.109999999999999 111.772 177.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.41 ' HB3' HD21 ' A' ' 60' ' ' LEU . 61.4 m-20 -54.33 -44.13 71.81 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 124.859 1.264 . . . . 71.420000000000002 112.66 179.69 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 61.2 ttp180 -59.62 -43.68 93.7 Favored 'General case' 0 CA--C 1.556 1.184 0 CA-C-N 115.823 -0.626 . . . . 74.340000000000003 111.563 177.044 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.6 t -69.28 -38.95 78.45 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 C-N-CA 123.582 0.753 . . . . 73.120000000000005 111.534 -177.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 90.2 mt -63.72 -52.24 59.78 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 C-N-CA 122.819 0.447 . . . . 53.399999999999999 111.012 177.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.407 ' HG ' HD13 ' A' ' 60' ' ' LEU . 97.6 mt -58.43 -34.92 71.33 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.129 0.572 . . . . 65.530000000000001 111.813 175.437 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 35.2 tp -63.48 -55.28 25.37 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.183 0.593 . . . . 72.140000000000001 111.121 178.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 54.6 mm-40 -72.43 -23.77 61.12 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 112.874 0.694 . . . . 64.549999999999997 112.874 -176.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 91.3 m -69.71 -30.01 67.54 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 122.719 0.408 . . . . 53.130000000000003 111.238 175.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -86.69 -33.31 20.09 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 123.601 0.76 . . . . 75.340000000000003 111.8 174.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 50.9 mtpt -75.16 -74.9 0.19 Allowed 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 123.493 0.717 . . . . 60.229999999999997 111.651 178.524 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 27.2 mtp180 -79.91 -36.93 35.7 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 124.175 0.99 . . . . 63.310000000000002 110.353 -172.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 122.07 160.4 10.95 Favored Glycine 0 CA--C 1.538 1.497 0 CA-C-N 115.363 -0.835 . . . . 52.439999999999998 111.967 -176.425 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -77.64 38.24 0.66 Allowed 'Trans proline' 0 CA--C 1.563 1.937 0 C-N-CA 123.568 2.845 . . . . 53.200000000000003 113.593 176.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 34.8 t -75.7 154.24 36.58 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.709 0.804 . . . . 62.439999999999998 111.788 179.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 98.3 p -61.33 -34.53 75.41 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.847 0.859 . . . . 70.299999999999997 111.877 178.092 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt -74.46 -19.51 60.36 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.256 0.622 . . . . 55.32 112.015 177.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 51.6 m -78.17 -33.91 49.91 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 109.183 -0.673 . . . . 65.439999999999998 109.183 173.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -70.64 -30.96 67.72 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.429 0.692 . . . . 72.219999999999999 111.245 173.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.96 -36.12 77.53 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.339 0.656 . . . . 55.100000000000001 111.566 171.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 82.4 t80 -63.57 -48.68 76.46 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 123.303 0.641 . . . . 73.349999999999994 110.704 171.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.453 ' HB2' HG11 ' A' ' 53' ' ' VAL . 59.9 mt -66.77 -23.05 66.03 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 124.603 1.161 . . . . 71.239999999999995 112.303 178.218 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.87 -53.52 49.18 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.102 0.561 . . . . 73.329999999999998 111.172 171.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -71.54 -28.21 63.72 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.09 0.556 . . . . 64.099999999999994 112.436 179.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.408 ' HE3' ' HA ' ' A' ' 45' ' ' LYS . 0.2 OUTLIER -72.8 -47.32 47.52 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.508 0.723 . . . . 72.329999999999998 111.247 178.686 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 52.1 mt -101.22 5.22 42.48 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.449 0.7 . . . . 71.239999999999995 112.444 -172.14 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 61.65 29.67 18.25 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 124.304 1.042 . . . . 42.310000000000002 112.217 -177.008 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.0 mmtm -104.0 -165.81 1.19 Allowed 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 124.565 1.146 . . . . 73.409999999999997 110.434 178.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -119.96 145.59 40.09 Favored Pre-proline 0 N--CA 1.489 1.49 0 CA-C-O 118.36 -0.829 . . . . 71.340000000000003 110.43 178.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -50.78 -46.03 32.44 Favored 'Trans proline' 0 C--N 1.385 2.487 0 C-N-CA 123.638 2.892 . . . . 75.019999999999996 114.801 -174.395 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -66.31 -41.59 89.47 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.643 0.777 . . . . 55.25 111.13 179.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -67.22 -34.7 78.03 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.725 0.81 . . . . 72.549999999999997 111.995 -178.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.453 HG11 ' HB2' ' A' ' 42' ' ' LEU . 60.6 t -71.77 -38.9 67.52 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 C-N-CA 123.016 0.526 . . . . 74.530000000000001 110.583 174.041 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.2 t -59.91 -44.46 94.26 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.954 0.901 . . . . 35.310000000000002 111.093 177.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -63.65 -43.9 95.39 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.06 0.544 . . . . 64.400000000000006 110.986 173.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 23.5 tpt180 -63.68 -35.22 79.82 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.629 0.772 . . . . 55.100000000000001 112.666 -176.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -54.71 -47.47 73.69 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.601 0.761 . . . . 74.0 110.873 171.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -73.95 -24.29 59.62 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 115.191 -0.913 . . . . 74.450000000000003 112.04 -178.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 17.4 mm-40 -70.19 -38.04 75.24 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.111 0.564 . . . . 73.310000000000002 110.173 172.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.41 HD21 ' HB3' ' A' ' 22' ' ' ASP . 31.7 mt -60.87 -53.55 56.0 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.179 0.992 . . . . 72.349999999999994 111.577 175.03 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 90.1 mmm . . . . . 0 N--CA 1.484 1.237 0 C-N-CA 122.954 0.502 . . . . 63.329999999999998 111.651 178.422 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . 0.464 ' CH2' ' HG3' ' A' ' 48' ' ' LYS . 96.8 m95 . . . . . 0 N--CA 1.481 1.075 0 N-CA-C 110.238 -0.282 . . . . 73.109999999999999 110.238 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 82.1 p -128.75 170.22 13.57 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 123.345 0.658 . . . . 62.409999999999997 111.304 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 39.5 ptt180 -52.76 -29.71 28.75 Favored 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 124.807 1.243 . . . . 72.540000000000006 113.576 -175.054 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.442 ' O ' HG23 ' A' ' 24' ' ' VAL . 18.3 m120 -77.87 -44.46 27.09 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 123.284 0.634 . . . . 75.310000000000002 111.714 177.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -59.5 -49.78 76.46 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 122.983 0.513 . . . . 54.119999999999997 111.582 -178.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.682 ' HB2' HD21 ' A' ' 60' ' ' LEU . 2.9 p30 -68.72 -32.45 72.26 Favored 'General case' 0 CA--C 1.558 1.282 0 CA-C-N 115.519 -0.764 . . . . 71.310000000000002 112.243 -177.769 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -63.85 -37.41 87.28 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 123.302 0.641 . . . . 75.439999999999998 111.296 173.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 20' ' ' ASN . 86.4 t -69.0 -38.03 77.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 C-N-CA 123.242 0.617 . . . . 73.129999999999995 111.298 176.338 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.404 HD11 ' CZ3' ' A' ' 17' ' ' TRP . 81.9 mt -55.96 -57.49 8.15 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 C-N-CA 122.439 0.295 . . . . 73.219999999999999 110.243 173.657 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.515 ' HG ' HD13 ' A' ' 60' ' ' LEU . 96.0 mt -60.12 -36.52 77.66 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.638 0.775 . . . . 72.319999999999993 112.517 178.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 42.5 tp -59.61 -59.07 6.03 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.138 0.575 . . . . 72.219999999999999 110.701 -179.006 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -70.69 -25.54 63.02 Favored 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 123.338 0.655 . . . . 71.329999999999998 112.536 -179.552 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 90.4 m -73.66 -36.79 65.41 Favored 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 112.353 0.501 . . . . 61.420000000000002 112.353 178.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -81.5 -30.71 33.19 Favored 'General case' 0 N--CA 1.492 1.627 0 CA-C-O 121.378 0.609 . . . . 71.219999999999999 111.03 176.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -72.17 -46.66 55.44 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 125.147 1.379 . . . . 70.439999999999998 112.522 178.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 53.3 mtp180 -114.78 -25.08 8.39 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 123.91 0.884 . . . . 55.140000000000001 112.722 -170.353 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 108.65 129.13 5.87 Favored Glycine 0 N--CA 1.479 1.52 0 CA-C-O 118.915 -0.936 . . . . 41.350000000000001 111.879 -173.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -74.2 85.43 1.4 Allowed 'Trans proline' 0 C--N 1.377 2.053 0 C-N-CA 122.618 2.212 . . . . 64.319999999999993 112.684 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 18.0 t -141.19 -179.24 5.99 Favored 'General case' 0 N--CA 1.482 1.159 0 CA-C-N 115.42 -0.809 . . . . 75.450000000000003 110.496 178.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 84.0 p -58.8 -36.44 74.45 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 114.156 1.169 . . . . 74.140000000000001 114.156 -169.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -70.0 -27.49 64.74 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 123.004 0.522 . . . . 73.0 111.866 -178.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 70.4 m -85.66 -43.76 13.16 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.437 0.695 . . . . 63.049999999999997 109.987 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -67.84 -29.29 68.39 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.363 0.665 . . . . 75.109999999999999 112.051 178.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.19 -39.92 90.03 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 122.918 0.487 . . . . 75.5 111.211 173.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 66.8 t80 -65.41 -51.09 62.75 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 116.077 -0.511 . . . . 72.200000000000003 110.686 174.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 79.4 mt -59.64 -31.02 69.14 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 124.362 1.065 . . . . 75.349999999999994 112.56 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.71 -56.04 14.18 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.344 0.657 . . . . 72.150000000000006 111.022 172.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.82 -25.8 68.07 Favored 'General case' 0 CA--C 1.56 1.363 0 C-N-CA 123.655 0.782 . . . . 50.009999999999998 112.617 178.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -76.89 -52.11 10.04 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 124.124 0.97 . . . . 74.219999999999999 111.34 -177.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.413 ' HB2' ' HG2' ' A' ' 48' ' ' LYS . 51.4 mt -91.19 -2.42 57.51 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 124.082 0.953 . . . . 61.149999999999999 111.904 -176.141 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.5 t70 69.25 33.5 3.25 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 125.312 1.445 . . . . 71.409999999999997 111.425 -177.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.464 ' HG3' ' CH2' ' A' ' 17' ' ' TRP . 67.9 mmtt -105.33 -167.18 1.3 Allowed 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 124.489 1.116 . . . . 74.329999999999998 110.749 177.289 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -118.71 149.04 45.63 Favored Pre-proline 0 N--CA 1.489 1.523 0 C-N-CA 123.751 0.82 . . . . 72.400000000000006 109.996 171.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -51.36 -42.1 56.27 Favored 'Trans proline' 0 C--N 1.387 2.556 0 C-N-CA 123.689 2.926 . . . . 73.219999999999999 115.761 -172.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -65.27 -39.73 93.0 Favored 'General case' 0 N--CA 1.494 1.733 0 C-N-CA 122.621 0.368 . . . . 74.310000000000002 111.437 177.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.443 ' O ' ' HD3' ' A' ' 56' ' ' ARG . 79.7 mt-30 -65.79 -31.18 72.01 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.552 0.741 . . . . 72.040000000000006 111.234 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 95.7 t -74.89 -46.95 39.28 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.145 0 C-N-CA 123.517 0.727 . . . . 72.120000000000005 111.016 175.168 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 35.0 t -64.73 -36.13 83.3 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 124.103 0.961 . . . . 74.349999999999994 112.801 -174.438 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -71.94 -39.31 69.5 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 122.671 0.388 . . . . 70.420000000000002 111.874 177.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.443 ' HD3' ' O ' ' A' ' 52' ' ' GLN . 5.7 mpt_? -69.53 -29.39 66.98 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 122.647 0.379 . . . . 64.040000000000006 111.026 176.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.48 ' HA ' HD12 ' A' ' 60' ' ' LEU . 8.2 t80 -55.37 -43.8 75.46 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.705 0.802 . . . . 75.439999999999998 111.019 168.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -74.75 -25.13 58.88 Favored 'General case' 0 CA--C 1.558 1.257 0 C-N-CA 123.47 0.708 . . . . 71.409999999999997 112.38 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -74.36 -31.85 62.55 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.346 0.593 . . . . 64.049999999999997 110.244 171.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.682 HD21 ' HB2' ' A' ' 22' ' ' ASP . 38.6 mt -65.83 -34.82 79.03 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.189 0.996 . . . . 72.239999999999995 111.482 172.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 33.8 mmt . . . . . 0 N--CA 1.482 1.15 0 C-N-CA 123.008 0.523 . . . . 74.109999999999999 111.564 175.204 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 82.4 m95 . . . . . 0 N--CA 1.477 0.889 0 CA-C-O 120.607 0.242 . . . . 75.439999999999998 110.802 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 30.1 p -97.03 155.95 16.57 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 108.324 -0.991 . . . . 65.019999999999996 108.324 171.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 35.3 ptt180 -58.93 -20.31 50.82 Favored 'General case' 0 CA--C 1.558 1.253 0 N-CA-C 112.237 0.458 . . . . 74.120000000000005 112.237 176.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -71.19 -40.49 71.19 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.969 0.908 . . . . 62.340000000000003 111.472 175.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.436 ' HA ' HD22 ' A' ' 46' ' ' LEU . 28.9 m-20 -60.54 -61.65 2.43 Favored 'General case' 0 N--CA 1.487 1.378 0 CA-C-O 121.49 0.662 . . . . 75.140000000000001 111.281 176.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.576 ' HB2' HD11 ' A' ' 60' ' ' LEU . 1.7 p30 -64.91 -28.67 69.69 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 113.624 0.972 . . . . 63.409999999999997 113.624 -174.231 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 28.2 tpt85 -56.21 -38.67 71.34 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 123.03 0.532 . . . . 73.150000000000006 111.921 173.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 44.0 t -72.9 -31.54 36.4 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 123.332 0.653 . . . . 73.349999999999994 111.184 177.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 66.0 mt -59.86 -47.19 92.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 C-N-CA 122.527 0.331 . . . . 65.109999999999999 110.34 172.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.411 HD21 ' HB3' ' A' ' 60' ' ' LEU . 97.4 mt -56.26 -38.96 71.86 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.741 0.817 . . . . 71.140000000000001 112.002 175.181 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 57.8 tp -63.81 -59.17 4.88 Favored 'General case' 0 CA--C 1.556 1.175 0 C-N-CA 123.419 0.688 . . . . 72.519999999999996 111.739 179.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -69.95 -22.15 63.2 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 113.236 0.828 . . . . 63.219999999999999 113.236 -175.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 65.7 m -69.8 -30.09 67.54 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 122.458 0.303 . . . . 43.329999999999998 111.415 173.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -84.19 -39.17 19.69 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 122.965 0.506 . . . . 75.319999999999993 111.026 174.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -61.44 -64.36 0.97 Allowed 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.975 0.91 . . . . 75.540000000000006 111.789 178.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.49 ' HD2' HG23 ' A' ' 38' ' ' THR . 37.5 mtt-85 -91.07 -52.19 4.96 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.74 0.816 . . . . 70.549999999999997 110.976 -174.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 131.08 147.1 5.97 Favored Glycine 0 CA--C 1.534 1.249 0 CA-C-N 115.157 -0.929 . . . . 34.109999999999999 111.391 -173.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -61.06 95.61 0.12 Allowed 'Trans proline' 0 C--N 1.374 1.869 0 C-N-CA 122.894 2.396 . . . . 73.420000000000002 112.445 175.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 48.3 t -146.95 157.06 43.52 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.985 0.914 . . . . 72.140000000000001 110.531 -175.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 81.0 p -65.34 -31.94 73.33 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.457 0.703 . . . . 73.530000000000001 112.407 -177.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -69.95 -26.66 64.22 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 123.286 0.634 . . . . 72.340000000000003 111.726 174.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.49 HG23 ' HD2' ' A' ' 32' ' ' ARG . 97.3 m -77.97 -42.99 31.01 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.759 0.823 . . . . 72.099999999999994 109.152 177.161 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -63.86 -28.81 70.1 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 124.028 0.931 . . . . 73.040000000000006 111.318 173.285 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.556 ' HA ' ' HG3' ' A' ' 50' ' ' PRO . . . -69.24 -42.35 75.75 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.372 0.669 . . . . 45.140000000000001 111.522 175.705 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -59.71 -49.41 77.84 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-O 121.077 0.465 . . . . 70.129999999999995 110.51 171.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 64.9 mt -63.74 -23.97 67.58 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.537 1.135 . . . . 74.230000000000004 112.741 178.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.77 -53.95 33.66 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.127 0.571 . . . . 73.120000000000005 110.727 172.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.27 -35.29 80.58 Favored 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 123.308 0.643 . . . . 25.399999999999999 111.635 177.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 58.2 tptt -66.93 -49.7 64.71 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.542 1.137 . . . . 75.420000000000002 111.693 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.436 HD22 ' HA ' ' A' ' 21' ' ' ASP . 64.9 mt -96.1 -2.15 47.14 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 113.013 0.746 . . . . 45.43 113.013 -172.715 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 79.88 -1.21 2.1 Favored 'General case' 0 N--CA 1.505 2.312 0 C-N-CA 126.117 1.767 . . . . 74.420000000000002 113.398 -178.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -88.88 -168.02 2.06 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 112.31 0.485 . . . . 64.010000000000005 112.31 -179.532 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -108.43 152.73 42.17 Favored Pre-proline 0 N--CA 1.484 1.248 0 C-N-CA 124.229 1.012 . . . . 75.040000000000006 110.126 173.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.556 ' HG3' ' HA ' ' A' ' 40' ' ' ALA . 37.4 Cg_exo -57.17 -34.17 97.26 Favored 'Trans proline' 0 C--N 1.39 2.72 0 C-N-CA 123.439 2.759 . . . . 74.209999999999994 114.203 -172.37 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.423 ' O ' ' HG3' ' A' ' 55' ' ' GLU . 18.3 m120 -67.78 -39.75 84.06 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.372 0.669 . . . . 65.239999999999995 111.497 177.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -66.33 -42.22 88.49 Favored 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 123.225 0.61 . . . . 73.239999999999995 110.453 177.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 82.0 t -57.58 -41.15 78.47 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 124.314 1.046 . . . . 65.049999999999997 111.049 173.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.499 ' O ' ' HG3' ' A' ' 58' ' ' GLN . 34.3 t -65.59 -41.25 93.05 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.152 0.581 . . . . 70.120000000000005 111.503 178.422 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.423 ' HG3' ' O ' ' A' ' 51' ' ' ASN . 52.0 mt-10 -57.98 -49.55 76.44 Favored 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 123.049 0.54 . . . . 60.420000000000002 111.142 176.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.4 tpm_? -62.16 -39.1 91.5 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 124.169 0.988 . . . . 71.510000000000005 111.818 176.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.415 ' HA ' HD12 ' A' ' 60' ' ' LEU . 16.0 t80 -56.14 -49.77 73.01 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 124.59 1.156 . . . . 71.019999999999996 112.252 177.288 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.499 ' HG3' ' O ' ' A' ' 54' ' ' SER . 62.3 mt-30 -68.59 -25.83 65.07 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.479 0.711 . . . . 73.109999999999999 111.439 -176.391 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 71.2 mt-30 -71.31 -47.73 54.96 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 115.427 -0.806 . . . . 71.239999999999995 109.668 171.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.576 HD11 ' HB2' ' A' ' 22' ' ' ASP . 58.2 mt -52.93 -46.65 68.2 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 124.497 1.119 . . . . 55.210000000000001 112.603 178.34 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 33.9 mmt . . . . . 0 N--CA 1.482 1.14 0 C-N-CA 123.102 0.561 . . . . 75.030000000000001 111.822 -179.155 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 95.4 m95 . . . . . 0 N--CA 1.484 1.273 0 N-CA-C 110.025 -0.361 . . . . 65.040000000000006 110.025 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 27.1 p -106.03 166.88 10.18 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.2 0.6 . . . . 65.349999999999994 109.845 179.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.47 -20.77 66.39 Favored 'General case' 0 CA--C 1.552 1.048 0 CA-C-N 115.923 -0.58 . . . . 74.120000000000005 112.461 175.784 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -73.13 -43.33 61.78 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.651 0.78 . . . . 63.409999999999997 110.66 173.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -57.84 -44.95 86.82 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.893 0.477 . . . . 74.129999999999995 110.848 171.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 -56.64 -53.13 61.19 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 124.111 0.964 . . . . 73.209999999999994 111.511 176.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 19.8 tpp180 -55.64 -47.76 76.11 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.911 0.884 . . . . 74.150000000000006 111.636 179.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 82.2 t -66.64 -43.7 90.2 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.152 0 C-N-CA 122.936 0.494 . . . . 72.420000000000002 112.137 -177.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 73.4 mt -56.79 -53.01 47.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 CA-C-N 118.324 0.511 . . . . 74.439999999999998 111.18 175.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.418 HD11 HD22 ' A' ' 60' ' ' LEU . 73.3 mt -61.25 -37.49 83.28 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 123.789 0.836 . . . . 74.409999999999997 112.231 -179.53 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 36.2 tp -73.78 -58.15 3.5 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.336 0.654 . . . . 62.229999999999997 111.734 -176.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.601 ' HB2' HD21 ' A' ' 42' ' ' LEU . 4.2 mm-40 -66.89 -23.51 66.01 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.141 0.576 . . . . 74.129999999999995 112.1 -175.286 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 99.2 m -70.77 -29.92 66.26 Favored 'General case' 0 N--CA 1.493 1.715 0 C-N-CA 122.932 0.493 . . . . 73.230000000000004 111.742 172.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -77.58 -25.89 50.34 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.874 -0.517 . . . . 74.340000000000003 111.438 172.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.1 mpmm? -76.17 -62.74 1.51 Allowed 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.59 0.756 . . . . 72.25 111.633 178.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 7.4 mpt_? -93.13 -2.73 55.09 Favored 'General case' 0 N--CA 1.49 1.525 0 N-CA-C 112.826 0.676 . . . . 73.200000000000003 112.826 -174.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.73 146.22 18.6 Favored Glycine 0 N--CA 1.487 2.041 0 CA-C-O 119.095 -0.836 . . . . 65.299999999999997 112.602 -173.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -77.49 43.05 1.25 Allowed 'Trans proline' 0 C--N 1.376 1.991 0 C-N-CA 123.373 2.715 . . . . 64.519999999999996 113.543 -177.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 42.6 m -97.35 168.68 10.26 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.18 0.992 . . . . 61.43 111.543 -177.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.429 ' HA ' ' HD2' ' A' ' 39' ' ' PHE . 89.9 p -61.1 -30.87 70.62 Favored 'General case' 0 N--CA 1.499 1.99 0 C-N-CA 123.35 0.66 . . . . 75.200000000000003 112.26 179.282 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 62.3 tttm -58.45 -28.24 65.11 Favored 'General case' 0 CA--C 1.559 1.318 0 C-N-CA 124.392 1.077 . . . . 71.310000000000002 112.165 175.252 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 59.4 m -93.26 -34.23 13.64 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.524 0.73 . . . . 73.329999999999998 110.959 -178.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . 0.429 ' HD2' ' HA ' ' A' ' 36' ' ' SER . 33.8 m-85 -62.54 -33.69 75.43 Favored 'General case' 0 N--CA 1.489 1.518 0 CA-C-O 121.153 0.501 . . . . 74.519999999999996 111.418 174.271 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.16 -41.36 94.78 Favored 'General case' 0 CA--C 1.557 1.234 0 C-N-CA 123.693 0.797 . . . . 73.219999999999999 111.493 173.22 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 77.0 t80 -62.34 -52.33 64.09 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.825 0.85 . . . . 64.129999999999995 111.209 174.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.601 HD21 ' HB2' ' A' ' 28' ' ' GLU . 80.7 mt -60.24 -31.37 70.13 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 125.094 1.357 . . . . 75.329999999999998 113.031 -178.764 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.37 -53.37 58.4 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.326 0.65 . . . . 70.549999999999997 111.639 175.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.56 -27.76 62.41 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 122.859 0.463 . . . . 22.23 111.968 177.031 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -72.66 -30.51 64.34 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 124.153 0.981 . . . . 74.209999999999994 111.787 -178.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 97.0 mt -116.33 4.66 13.46 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.618 0.767 . . . . 52.219999999999999 112.427 -177.36 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 61.34 27.53 17.16 Favored 'General case' 0 N--CA 1.497 1.9 0 C-N-CA 124.231 1.013 . . . . 72.450000000000003 112.594 -176.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -102.54 -174.67 2.62 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.369 1.067 . . . . 72.439999999999998 111.132 179.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -107.71 140.66 21.79 Favored Pre-proline 0 N--CA 1.486 1.353 0 C-N-CA 123.656 0.782 . . . . 74.200000000000003 109.402 175.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -56.43 -34.58 94.91 Favored 'Trans proline' 0 C--N 1.387 2.569 0 C-N-CA 123.105 2.536 . . . . 54.229999999999997 113.644 -172.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -60.35 -48.05 83.42 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.183 0.993 . . . . 73.519999999999996 111.024 175.12 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -72.97 -30.24 63.67 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.687 0.795 . . . . 64.420000000000002 111.681 -177.041 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 71.4 t -65.52 -44.03 94.14 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 123.292 0.637 . . . . 75.040000000000006 110.55 173.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 44.1 t -64.57 -42.97 95.29 Favored 'General case' 0 N--CA 1.485 1.302 0 CA-C-N 115.952 -0.567 . . . . 75.439999999999998 111.265 177.123 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -60.73 -44.47 96.6 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 123.576 0.751 . . . . 72.430000000000007 111.944 175.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 16.3 tpt180 -68.57 -39.15 81.12 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 122.642 0.377 . . . . 72.299999999999997 111.201 179.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -58.44 -53.03 62.97 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 124.063 0.945 . . . . 73.349999999999994 111.631 179.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 66.6 mt-30 -73.04 -26.7 61.39 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-N 115.324 -0.853 . . . . 71.109999999999999 111.226 -176.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 12.3 tm0? -69.7 -41.59 75.18 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 123.6 0.76 . . . . 72.209999999999994 109.366 173.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.418 HD22 HD11 ' A' ' 26' ' ' LEU . 13.0 mt -56.15 -48.13 76.87 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 124.355 1.062 . . . . 73.530000000000001 110.895 172.556 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 29.2 mmt . . . . . 0 N--CA 1.485 1.291 0 C-N-CA 123.235 0.614 . . . . 72.150000000000006 111.22 176.382 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . 0.686 ' HZ2' ' HB3' ' A' ' 52' ' ' GLN . 81.6 m95 . . . . . 0 N--CA 1.477 0.924 0 N-CA-C 109.89 -0.411 . . . . 74.409999999999997 109.89 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 43.9 p -96.67 161.52 13.84 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 122.814 0.446 . . . . 51.130000000000003 110.834 -178.177 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 35.0 ptt180 -57.65 -23.26 50.33 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.527 0.731 . . . . 74.450000000000003 111.904 171.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -69.69 -46.24 66.47 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 123.905 0.882 . . . . 75.439999999999998 110.73 175.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.4 m-20 -58.61 -47.09 85.52 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.017 0.527 . . . . 53.130000000000003 111.234 174.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.448 ' HB3' HD21 ' A' ' 60' ' ' LEU . 56.5 m-20 -55.94 -47.16 78.07 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.157 0.983 . . . . 75.25 112.254 176.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 32.3 ttm180 -61.57 -40.22 93.98 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.915 0.486 . . . . 72.510000000000005 112.016 179.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 85.4 t -69.27 -40.0 79.75 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 122.73 0.412 . . . . 72.450000000000003 111.643 178.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 81.3 mt -58.88 -43.58 88.75 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 CA-C-O 120.877 0.37 . . . . 54.229999999999997 110.991 175.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 88.5 mt -70.94 -35.04 72.04 Favored 'General case' 0 CA--C 1.555 1.149 0 C-N-CA 123.287 0.635 . . . . 73.530000000000001 111.694 176.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 31.0 tp -67.27 -52.0 46.11 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.862 0.865 . . . . 71.340000000000003 111.719 -176.293 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -74.42 -20.49 60.03 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.123 0.569 . . . . 65.150000000000006 111.684 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 53.4 t -72.08 -34.7 68.89 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 122.85 0.46 . . . . 72.230000000000004 111.174 171.2 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -79.74 -15.61 57.18 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.158 0.583 . . . . 72.530000000000001 111.423 172.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 56.2 tptt -80.78 -48.38 12.56 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 123.694 0.798 . . . . 64.319999999999993 110.94 175.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 50.6 mtt180 -106.46 -63.58 1.26 Allowed 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.737 0.815 . . . . 75.430000000000007 111.447 -178.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 136.7 154.1 6.66 Favored Glycine 0 CA--C 1.539 1.544 0 CA-C-O 119.086 -0.841 . . . . 71.120000000000005 111.694 -172.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_exo -57.68 109.08 0.43 Allowed 'Trans proline' 0 C--N 1.374 1.88 0 C-N-CA 123.128 2.552 . . . . 44.310000000000002 113.168 176.319 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 46.7 t -156.39 155.37 32.03 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.316 0.646 . . . . 71.430000000000007 111.371 -177.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 58.4 p -62.91 -33.47 75.4 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.547 0.739 . . . . 73.310000000000002 111.23 172.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -63.96 -33.85 76.65 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.516 0.726 . . . . 73.349999999999994 111.124 173.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 38.4 m -83.36 -27.98 29.29 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 123.276 0.63 . . . . 55.420000000000002 110.192 -176.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 22.5 m-30 -69.35 -36.29 76.73 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.242 0.617 . . . . 63.340000000000003 110.849 172.483 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.02 -39.84 87.12 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 123.451 0.7 . . . . 73.200000000000003 110.924 173.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -65.54 -39.52 91.84 Favored 'General case' 0 CA--C 1.557 1.242 0 C-N-CA 124.425 1.09 . . . . 73.120000000000005 111.876 176.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.465 ' HB2' HG11 ' A' ' 53' ' ' VAL . 39.5 mt -73.41 -29.28 62.49 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 124.168 0.987 . . . . 72.140000000000001 112.248 175.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.47 -39.18 93.77 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 122.867 0.467 . . . . 55.25 110.385 171.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -71.36 -43.27 67.24 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 123.52 0.728 . . . . 43.329999999999998 112.001 175.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -70.05 -39.91 75.41 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.937 0.895 . . . . 71.140000000000001 112.09 -172.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 91.9 mt -100.26 -3.48 31.33 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.601 0.761 . . . . 75.430000000000007 112.962 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 60.15 25.01 14.32 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 124.246 1.018 . . . . 72.439999999999998 112.311 -177.192 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 48.6 mmtm -94.43 171.9 8.53 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 124.197 0.999 . . . . 71.150000000000006 110.291 177.324 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 37.4 m-80 -75.62 145.05 78.17 Favored Pre-proline 0 N--CA 1.486 1.333 0 CA-C-O 118.944 -0.55 . . . . 64.310000000000002 110.127 174.359 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -60.42 -28.83 87.49 Favored 'Trans proline' 0 C--N 1.381 2.252 0 C-N-CA 122.443 2.096 . . . . 73.319999999999993 112.503 178.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -72.27 -39.53 68.3 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.283 1.033 . . . . 71.349999999999994 110.629 177.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.686 ' HB3' ' HZ2' ' A' ' 17' ' ' TRP . 24.3 mm-40 -63.73 -38.27 90.49 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.603 0.761 . . . . 73.150000000000006 111.906 173.419 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.465 HG11 ' HB2' ' A' ' 42' ' ' LEU . 69.6 t -69.64 -48.88 63.0 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 C-N-CA 123.268 0.627 . . . . 73.109999999999999 111.877 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 79.9 p -58.04 -42.72 86.0 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 123.117 0.567 . . . . 71.319999999999993 111.48 179.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -61.83 -52.58 63.58 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.989 0.516 . . . . 71.109999999999999 112.203 173.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 28.4 tpt180 -65.25 -31.3 72.39 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 122.896 0.479 . . . . 73.430000000000007 112.108 -174.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -57.27 -52.28 65.95 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.869 0.868 . . . . 73.019999999999996 110.847 171.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -73.77 -23.36 59.71 Favored 'General case' 0 CA--C 1.552 1.035 0 CA-C-N 115.472 -0.786 . . . . 64.040000000000006 112.219 -176.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 36.1 mm-40 -65.86 -46.94 76.6 Favored 'General case' 0 N--CA 1.484 1.259 0 N-CA-C 109.469 -0.567 . . . . 43.439999999999998 109.469 168.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.448 HD21 ' HB3' ' A' ' 22' ' ' ASP . 21.6 mt -58.62 -45.22 89.68 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.298 1.039 . . . . 70.5 112.304 175.77 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 36.0 mmt . . . . . 0 N--CA 1.491 1.616 0 CA-C-O 121.261 0.553 . . . . 74.209999999999994 111.295 177.411 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 89.6 m95 . . . . . 0 N--CA 1.491 1.586 0 N-CA-C 110.061 -0.348 . . . . 71.329999999999998 110.061 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 15.8 p -101.59 165.78 11.05 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 109.902 -0.407 . . . . 71.540000000000006 109.902 173.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 20.2 ptp180 -66.55 -21.37 66.15 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.211 0.604 . . . . 75.219999999999999 111.281 177.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.415 ' O ' HG23 ' A' ' 24' ' ' VAL . 5.8 m120 -75.58 -50.67 14.87 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.167 0.987 . . . . 63.539999999999999 110.097 179.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 52.7 m-20 -63.59 -42.31 98.28 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.132 0.573 . . . . 74.040000000000006 110.606 177.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -53.87 -50.42 66.31 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 125.034 1.334 . . . . 63.009999999999998 111.281 176.115 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.6 -29.14 65.47 Favored 'General case' 0 CA--C 1.558 1.257 0 CA-C-N 115.305 -0.861 . . . . 65.319999999999993 112.014 -178.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 20' ' ' ASN . 53.7 t -68.93 -40.88 81.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 C-N-CA 122.717 0.407 . . . . 54.420000000000002 110.952 173.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 86.8 mt -56.99 -59.42 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.364 0 O-C-N 123.306 0.378 . . . . 73.019999999999996 110.288 175.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.545 HD11 HD22 ' A' ' 60' ' ' LEU . 83.9 mt -59.8 -34.1 72.59 Favored 'General case' 0 N--CA 1.485 1.302 0 N-CA-C 112.833 0.679 . . . . 61.229999999999997 112.833 -176.486 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 37.6 tp -75.93 -57.0 4.13 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.135 0.574 . . . . 74.099999999999994 112.255 -175.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.749 ' HB2' HD21 ' A' ' 42' ' ' LEU . 24.5 mt-10 -77.75 -18.81 56.1 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 112.893 0.701 . . . . 74.219999999999999 112.893 -176.49 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.479 ' SG ' ' HA ' ' A' ' 34' ' ' PRO . 43.1 t -70.9 -51.01 28.8 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.635 0.374 . . . . 63.109999999999999 110.922 176.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -66.87 -27.91 67.91 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 122.863 0.465 . . . . 71.519999999999996 111.61 174.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 59.9 tptt -65.05 -50.08 67.61 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.814 0.845 . . . . 53.229999999999997 111.057 176.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 61.3 mtp85 -100.6 11.67 39.0 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 112.766 0.654 . . . . 71.129999999999995 112.766 -175.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 79.51 110.8 0.24 Allowed Glycine 0 CA--C 1.544 1.892 0 CA-C-O 118.762 -1.021 . . . . 61.229999999999997 112.377 178.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.479 ' HA ' ' SG ' ' A' ' 29' ' ' CYS . 20.1 Cg_endo -57.53 99.34 0.09 OUTLIER 'Trans proline' 0 C--N 1.382 2.32 0 C-N-CA 123.373 2.716 . . . . 52.240000000000002 113.691 -173.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 23.0 t -157.37 174.22 15.74 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.224 0.609 . . . . 74.230000000000004 112.004 -172.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 60.5 p -55.5 -50.33 70.22 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 124.78 1.232 . . . . 73.140000000000001 113.689 -175.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 26.5 mtpp -69.22 -15.13 63.31 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 112.9 0.704 . . . . 54.329999999999998 112.9 -178.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.404 HG21 ' HA ' ' A' ' 29' ' ' CYS . 27.5 m -87.31 -34.06 19.0 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.469 0.708 . . . . 60.340000000000003 109.693 177.124 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -66.67 -35.67 80.7 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.212 0.605 . . . . 73.200000000000003 110.847 173.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.41 -36.55 83.11 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.455 0.702 . . . . 55.520000000000003 111.775 175.226 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -63.24 -55.66 23.05 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.376 0.67 . . . . 71.230000000000004 111.216 172.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.749 HD21 ' HB2' ' A' ' 28' ' ' GLU . 81.2 mt -62.17 -23.25 66.48 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 124.177 0.991 . . . . 75.049999999999997 112.616 178.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.3 -57.7 8.63 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.347 0.659 . . . . 70.430000000000007 111.32 173.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.9 -30.67 71.3 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-N 115.876 -0.602 . . . . 62.109999999999999 111.666 178.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.405 ' HE2' ' HA ' ' A' ' 45' ' ' LYS . 0.5 OUTLIER -68.28 -42.87 78.89 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 123.703 0.801 . . . . 75.239999999999995 111.78 177.801 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 89.8 mt -104.25 12.85 33.2 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 123.485 0.714 . . . . 74.219999999999999 112.831 -175.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.2 t70 64.18 16.09 9.8 Favored 'General case' 0 CA--C 1.575 1.911 0 C-N-CA 124.064 0.946 . . . . 74.319999999999993 112.558 175.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -107.83 -175.11 2.69 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.777 0.831 . . . . 74.450000000000003 112.008 -178.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -91.65 150.98 41.93 Favored Pre-proline 0 N--CA 1.484 1.236 0 C-N-CA 123.302 0.641 . . . . 73.209999999999994 110.145 176.608 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 79.1 Cg_exo -52.59 -35.41 67.18 Favored 'Trans proline' 0 C--N 1.384 2.402 0 C-N-CA 122.857 2.371 . . . . 54.350000000000001 113.618 174.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -64.46 -46.9 81.13 Favored 'General case' 0 CA--C 1.557 1.248 0 C-N-CA 123.172 0.589 . . . . 73.310000000000002 110.43 176.379 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -54.78 -46.84 74.47 Favored 'General case' 0 N--CA 1.499 1.977 0 C-N-CA 123.743 0.817 . . . . 73.219999999999999 112.008 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.536 HG11 ' HB2' ' A' ' 42' ' ' LEU . 69.4 t -65.7 -45.41 92.06 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 CA-C-N 115.286 -0.87 . . . . 65.319999999999993 111.183 179.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . 0.445 ' O ' ' HG3' ' A' ' 58' ' ' GLN . 35.0 t -58.09 -43.39 87.06 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.344 0.658 . . . . 71.310000000000002 111.6 177.286 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -62.09 -53.91 48.71 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.511 0.725 . . . . 72.140000000000001 111.64 178.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.409 ' HA ' ' HD2' ' A' ' 56' ' ' ARG . 10.7 tpt180 -61.59 -38.49 87.76 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 122.683 0.393 . . . . 75.420000000000002 111.621 -178.704 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -55.46 -52.62 63.02 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.853 0.861 . . . . 74.430000000000007 112.134 174.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.445 ' HG3' ' O ' ' A' ' 54' ' ' SER . 83.3 mt-30 -73.59 -24.39 60.06 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.326 0.65 . . . . 75.5 112.136 -175.493 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 19.1 mm-40 -68.3 -43.61 77.29 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 122.998 0.519 . . . . 63.229999999999997 109.641 170.113 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.545 HD22 HD11 ' A' ' 26' ' ' LEU . 14.3 mt -60.59 -45.55 93.53 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.285 1.034 . . . . 51.229999999999997 112.262 176.057 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 35.1 mmt . . . . . 0 N--CA 1.488 1.449 0 C-N-CA 123.364 0.666 . . . . 64.409999999999997 110.768 175.024 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . 0.583 ' HZ3' HD13 ' A' ' 46' ' ' LEU . 98.6 m95 . . . . . 0 N--CA 1.485 1.312 0 N-CA-C 110.414 -0.217 . . . . 75.329999999999998 110.414 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 18.0 p -122.2 158.16 30.02 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 109.259 -0.645 . . . . 71.120000000000005 109.259 170.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.6 ptp180 -63.24 -19.04 64.19 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 123.562 0.745 . . . . 72.019999999999996 112.673 176.541 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.471 ' O ' HG23 ' A' ' 24' ' ' VAL . 25.5 m-80 -68.55 -46.71 68.75 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.124 0.57 . . . . 74.239999999999995 109.755 170.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -62.92 -43.57 98.42 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 123.589 0.756 . . . . 74.5 111.24 176.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.674 ' HB3' HD21 ' A' ' 60' ' ' LEU . 68.7 m-20 -56.51 -42.68 78.8 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.742 1.217 . . . . 64.219999999999999 111.768 175.69 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 32.5 ttm180 -61.37 -45.68 93.35 Favored 'General case' 0 N--CA 1.483 1.186 0 CA-C-N 115.48 -0.782 . . . . 63.210000000000001 110.917 175.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.471 HG23 ' O ' ' A' ' 20' ' ' ASN . 78.2 t -62.34 -41.69 92.6 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 C-N-CA 123.988 0.915 . . . . 72.430000000000007 112.207 -177.835 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 88.6 mt -61.2 -52.86 56.5 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 C-N-CA 122.327 0.251 . . . . 72.420000000000002 110.803 177.429 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.491 ' HG ' HD13 ' A' ' 60' ' ' LEU . 94.1 mt -58.65 -37.08 75.19 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.489 0.716 . . . . 74.329999999999998 112.18 176.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 28.3 tp -74.82 -50.55 16.78 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.61 0.764 . . . . 61.32 111.706 -174.351 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -74.64 -18.74 60.5 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 123.171 0.588 . . . . 54.109999999999999 112.162 -177.519 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 87.2 m -66.17 -30.14 70.56 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 122.628 0.371 . . . . 52.549999999999997 111.092 166.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . 0.402 ' HG2' ' O ' ' A' ' 26' ' ' LEU . 12.6 mm100 -81.91 -24.49 35.64 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.995 0.518 . . . . 72.420000000000002 111.868 174.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.1 mptm? -71.83 -73.23 0.19 Allowed 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 121.27 0.557 . . . . 63.530000000000001 110.739 169.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.568 HH21 ' HG2' ' A' ' 37' ' ' LYS . 18.2 mtp180 -84.41 -53.99 5.07 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 123.941 0.896 . . . . 74.319999999999993 112.032 -171.238 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 131.25 163.35 10.87 Favored Glycine 0 N--CA 1.482 1.763 0 CA-C-O 119.525 -0.597 . . . . 73.040000000000006 113.076 -179.476 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -67.52 85.7 0.36 Allowed 'Trans proline' 0 C--N 1.379 2.142 0 C-N-CA 122.888 2.392 . . . . 50.329999999999998 111.905 173.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.2 m -141.72 148.55 39.21 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 124.108 0.963 . . . . 54.130000000000003 110.051 -176.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 89.9 p -61.76 -31.97 72.2 Favored 'General case' 0 N--CA 1.498 1.945 0 C-N-CA 123.281 0.632 . . . . 64.099999999999994 111.478 176.74 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.568 ' HG2' HH21 ' A' ' 32' ' ' ARG . 88.3 tttt -59.17 -34.45 72.13 Favored 'General case' 0 CA--C 1.561 1.397 0 C-N-CA 125.074 1.349 . . . . 71.319999999999993 111.751 173.229 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 87.5 m -79.11 -39.33 33.96 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 124.094 0.958 . . . . 72.329999999999998 110.18 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 26.7 m-85 -65.86 -26.89 67.85 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 115.179 -0.919 . . . . 72.109999999999999 111.95 175.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.31 -36.88 84.07 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.338 0.655 . . . . 70.200000000000003 111.668 173.206 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -66.44 -54.51 23.31 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 123.116 0.566 . . . . 74.010000000000005 110.642 172.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 96.1 mt -60.7 -23.06 64.58 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.459 1.104 . . . . 71.319999999999993 112.41 178.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.65 -57.5 9.86 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.231 0.612 . . . . 72.5 111.467 174.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -68.52 -27.58 66.24 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-N 115.544 -0.753 . . . . 75.230000000000004 112.161 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.451 ' HD3' HD23 ' A' ' 46' ' ' LEU . 0.6 OUTLIER -70.64 -58.18 3.94 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.731 0.813 . . . . 71.450000000000003 109.711 179.608 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.583 HD13 ' HZ3' ' A' ' 17' ' ' TRP . 41.4 mt -83.23 -5.35 59.1 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.475 0.71 . . . . 72.439999999999998 112.614 -173.402 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.1 t70 72.73 -2.71 2.58 Favored 'General case' 0 N--CA 1.498 1.935 0 C-N-CA 125.006 1.322 . . . . 64.140000000000001 112.146 -177.129 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.469 ' HA ' ' HE2' ' A' ' 48' ' ' LYS . 11.5 mmpt? -97.55 137.58 36.27 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.772 0.829 . . . . 70.030000000000001 110.058 -177.142 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 36.0 m-80 -52.19 149.44 9.77 Favored Pre-proline 0 N--CA 1.494 1.767 0 C-N-CA 123.49 0.716 . . . . 72.299999999999997 112.645 178.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -59.32 -22.12 63.87 Favored 'Trans proline' 0 C--N 1.387 2.601 0 C-N-CA 122.828 2.352 . . . . 52.020000000000003 113.082 -176.06 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -68.22 -43.76 77.28 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 124.022 0.929 . . . . 75.340000000000003 110.896 172.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 11.4 mm-40 -65.73 -41.88 91.7 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.393 0.677 . . . . 72.129999999999995 111.076 178.263 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 99.2 t -69.36 -43.83 80.73 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 C-N-CA 123.573 0.749 . . . . 64.239999999999995 111.807 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 93.5 p -62.67 -39.48 94.06 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.097 0.559 . . . . 74.400000000000006 111.029 179.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -72.5 -36.69 68.46 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 115.824 -0.625 . . . . 70.230000000000004 112.01 175.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -67.63 -34.97 78.05 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 122.775 0.43 . . . . 74.530000000000001 111.398 -179.195 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -53.63 -45.49 70.17 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.808 0.843 . . . . 75.209999999999994 110.242 169.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 40.4 mt-30 -74.48 -30.33 61.8 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 114.984 -1.007 . . . . 74.230000000000004 112.052 178.462 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -68.46 -38.62 81.25 Favored 'General case' 0 N--CA 1.497 1.885 0 C-N-CA 123.908 0.883 . . . . 72.099999999999994 110.788 178.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.674 HD21 ' HB3' ' A' ' 22' ' ' ASP . 32.7 mt -53.62 -51.77 62.0 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.281 1.032 . . . . 62.5 110.245 168.44 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 45.5 mtt . . . . . 0 CA--C 1.552 1.041 0 N-CA-C 113.335 0.865 . . . . 72.120000000000005 113.335 178.406 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . 0.434 ' CD2' ' HG3' ' A' ' 56' ' ' ARG . 95.9 m95 . . . . . 0 N--CA 1.481 1.099 0 CA-C-O 120.938 0.399 . . . . 72.299999999999997 110.212 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 72.2 p -131.68 168.1 18.32 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.43 1.092 . . . . 72.109999999999999 110.521 -172.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -56.59 -22.9 36.97 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 123.68 0.792 . . . . 52.210000000000001 113.113 -178.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.448 ' O ' HG23 ' A' ' 24' ' ' VAL . 10.9 m-80 -71.36 -49.79 38.77 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.54 0.736 . . . . 64.129999999999995 110.268 179.615 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.406 ' HB3' HD13 ' A' ' 46' ' ' LEU . 0.4 OUTLIER -72.45 -41.76 65.74 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-N 115.675 -0.693 . . . . 74.019999999999996 110.101 -176.524 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.486 ' HB3' HD21 ' A' ' 60' ' ' LEU . 2.1 m-20 -51.31 -44.71 62.0 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 124.735 1.214 . . . . 74.540000000000006 111.805 172.253 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 60.6 ttp180 -60.61 -45.88 92.37 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.51 0.724 . . . . 74.239999999999995 111.554 175.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.448 HG23 ' O ' ' A' ' 20' ' ' ASN . 58.3 t -63.07 -37.0 78.21 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.353 0 C-N-CA 123.567 0.747 . . . . 74.510000000000005 111.378 -179.501 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 86.8 mt -64.13 -50.03 78.75 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 C-N-CA 122.813 0.445 . . . . 73.129999999999995 110.875 175.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 95.3 mt -59.36 -33.08 70.73 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 123.358 0.663 . . . . 63.340000000000003 111.946 176.519 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 45.8 tp -69.35 -58.13 4.4 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.41 0.684 . . . . 64.340000000000003 110.883 179.368 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.59 ' HA ' ' HB3' ' A' ' 31' ' ' LYS . 75.2 mm-40 -68.26 -23.19 64.75 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.576 0.75 . . . . 71.340000000000003 112.614 -177.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 54.1 t -68.17 -29.05 67.83 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.208 0.603 . . . . 60.020000000000003 111.98 174.246 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -104.02 -15.07 15.7 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 123.2 0.6 . . . . 62.329999999999998 112.023 176.488 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.59 ' HB3' ' HA ' ' A' ' 28' ' ' GLU . 43.7 tttm -82.65 -49.52 9.72 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 124.154 0.982 . . . . 64.450000000000003 110.805 177.025 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 88.4 mtt180 -99.17 -64.11 1.07 Allowed 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.676 0.79 . . . . 52.32 110.303 171.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 152.39 173.94 22.44 Favored Glycine 0 CA--C 1.539 1.548 0 CA-C-N 115.266 -0.879 . . . . 73.310000000000002 111.912 -172.699 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -86.02 31.46 0.47 Allowed 'Trans proline' 0 CA--C 1.56 1.814 0 C-N-CA 123.002 2.468 . . . . 64.109999999999999 113.879 -179.471 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 43.2 t -80.09 161.03 25.56 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 123.358 0.663 . . . . 74.329999999999998 112.611 -177.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 78.3 p -65.49 -28.19 69.02 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 124.099 0.96 . . . . 73.409999999999997 111.93 176.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -76.65 -18.97 58.28 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.405 0.682 . . . . 72.340000000000003 111.743 176.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 56.7 m -82.37 -38.4 24.21 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 109.203 -0.665 . . . . 62.340000000000003 109.203 171.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -64.76 -29.26 70.23 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 115.658 -0.701 . . . . 73.340000000000003 110.977 173.058 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . 0.419 ' HA ' ' HG3' ' A' ' 50' ' ' PRO . . . -70.97 -34.79 71.76 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.668 0.787 . . . . 72.099999999999994 111.548 173.708 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -63.5 -54.96 28.16 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 109.726 -0.472 . . . . 72.420000000000002 109.726 171.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.437 ' HA ' ' HB3' ' A' ' 45' ' ' LYS . 52.2 mt -59.78 -24.73 64.33 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 125.271 1.428 . . . . 54.140000000000001 112.972 179.074 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.37 -55.47 17.99 Favored 'General case' 0 CA--C 1.552 1.03 0 CA-C-O 121.045 0.45 . . . . 53.119999999999997 110.742 172.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.49 -28.43 67.84 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.537 0.735 . . . . 71.040000000000006 112.118 177.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.437 ' HB3' ' HA ' ' A' ' 42' ' ' LEU . 23.1 tptm -76.2 -38.43 56.53 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.569 1.148 . . . . 72.319999999999993 111.594 -176.09 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.406 HD13 ' HB3' ' A' ' 21' ' ' ASP . 62.6 mt -112.52 11.32 19.74 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.659 0.784 . . . . 51.340000000000003 112.443 -173.331 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 64.37 21.71 12.56 Favored 'General case' 0 N--CA 1.506 2.359 0 C-N-CA 124.762 1.225 . . . . 54.43 112.684 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -109.94 -163.2 0.84 Allowed 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.725 0.81 . . . . 71.230000000000004 111.796 -175.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.493 ' HB2' HE21 ' A' ' 52' ' ' GLN . 26.1 m-80 -124.87 147.1 55.39 Favored Pre-proline 0 N--CA 1.487 1.385 0 C-N-CA 123.919 0.888 . . . . 75.209999999999994 109.984 178.882 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.419 ' HG3' ' HA ' ' A' ' 40' ' ' ALA . 50.6 Cg_exo -55.25 -27.99 59.72 Favored 'Trans proline' 0 C--N 1.382 2.32 0 C-N-CA 123.547 2.831 . . . . 55.140000000000001 115.659 -172.14 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -72.13 -44.81 62.55 Favored 'General case' 0 N--CA 1.494 1.768 0 C-N-CA 123.253 0.621 . . . . 64.209999999999994 111.117 176.015 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.493 HE21 ' HB2' ' A' ' 49' ' ' ASN . 43.4 mt-30 -57.46 -41.35 80.39 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 123.887 0.875 . . . . 72.209999999999994 111.993 172.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.413 HG11 ' HB2' ' A' ' 42' ' ' LEU . 66.8 t -69.78 -43.07 80.18 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.032 0 CA-C-N 115.76 -0.655 . . . . 74.450000000000003 111.291 177.722 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 45.2 t -60.01 -34.84 73.89 Favored 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 123.721 0.808 . . . . 73.239999999999995 111.658 177.332 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.19 -51.37 54.37 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 114.906 -1.043 . . . . 71.239999999999995 110.145 177.774 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.434 ' HG3' ' CD2' ' A' ' 17' ' ' TRP . 29.0 mmt-85 -65.8 -30.3 70.91 Favored 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 113.039 0.755 . . . . 63.450000000000003 113.039 -179.097 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.411 ' O ' ' HG2' ' A' ' 61' ' ' MET . 19.9 t80 -56.3 -52.94 62.66 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 122.738 0.415 . . . . 75.310000000000002 110.502 171.605 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 67.8 mt-30 -73.42 -24.93 60.33 Favored 'General case' 0 CA--C 1.554 1.099 0 CA-C-N 115.574 -0.739 . . . . 72.510000000000005 112.074 -176.468 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 21.2 mm-40 -71.27 -43.11 67.82 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.302 0.641 . . . . 72.530000000000001 110.166 172.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.486 HD21 ' HB3' ' A' ' 22' ' ' ASP . 25.3 mt -58.64 -45.69 88.74 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 124.31 1.044 . . . . 71.319999999999993 111.659 174.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . 0.411 ' HG2' ' O ' ' A' ' 57' ' ' PHE . 35.5 mmt . . . . . 0 N--CA 1.482 1.167 0 C-N-CA 123.129 0.572 . . . . 60.25 111.167 175.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . 0.51 ' HZ2' ' HB3' ' A' ' 52' ' ' GLN . 93.2 m95 . . . . . 0 CA--C 1.56 1.347 0 N-CA-C 110.512 -0.181 . . . . 65.040000000000006 110.512 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 80.6 p -119.54 -174.97 2.85 Favored 'General case' 0 N--CA 1.503 2.191 0 C-N-CA 123.746 0.818 . . . . 72.319999999999993 111.848 176.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 11.9 ptm180 -77.45 -18.59 57.05 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.243 0.617 . . . . 72.200000000000003 112.167 170.242 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.403 ' O ' HG23 ' A' ' 24' ' ' VAL . 77.9 m-20 -67.27 -36.08 80.84 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 123.499 0.719 . . . . 74.150000000000006 112.05 -176.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.38 -39.86 95.66 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 123.08 0.552 . . . . 74.200000000000003 111.035 -177.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.616 ' HA ' HD11 ' A' ' 60' ' ' LEU . 27.8 m-20 -49.93 -52.0 36.69 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.695 0.798 . . . . 73.340000000000003 111.313 175.487 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 42.0 ttt85 -58.77 -48.67 80.42 Favored 'General case' 0 CA--C 1.559 1.306 0 CA-C-N 114.834 -1.075 . . . . 74.450000000000003 112.707 176.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 20' ' ' ASN . 89.0 t -65.52 -44.65 94.0 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 C-N-CA 123.896 0.878 . . . . 74.040000000000006 112.314 -175.747 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 97.3 mt -69.03 -50.24 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.122 0 C-N-CA 123.711 0.804 . . . . 74.209999999999994 111.164 -178.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.482 HD11 HD22 ' A' ' 60' ' ' LEU . 95.3 mt -57.79 -27.87 63.5 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 112.421 0.526 . . . . 74.030000000000001 112.421 175.616 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.3 tp -74.49 -60.81 2.11 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 122.954 0.502 . . . . 51.130000000000003 111.814 177.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.413 ' HB2' HD21 ' A' ' 42' ' ' LEU . 71.2 mm-40 -72.4 -26.35 61.84 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 113.335 0.865 . . . . 74.140000000000001 113.335 -172.705 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 71.7 m -67.16 -44.38 79.89 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-O 120.948 0.404 . . . . 74.420000000000002 111.7 -178.567 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.6 pt20 -79.25 -32.41 43.77 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 122.618 0.367 . . . . 74.120000000000005 111.86 177.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 28.8 ttpp -80.27 -33.38 37.83 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.322 0.649 . . . . 75.340000000000003 112.279 -173.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 48.0 mtt180 -102.19 -59.93 1.62 Allowed 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.166 0.586 . . . . 73.530000000000001 111.77 179.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 164.15 173.34 32.7 Favored Glycine 0 CA--C 1.536 1.37 0 N-CA-C 114.66 0.624 . . . . 60.329999999999998 114.66 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -87.65 3.15 6.41 Favored 'Trans proline' 0 CA--C 1.557 1.65 0 C-N-CA 123.47 2.78 . . . . 64.430000000000007 114.147 -177.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 32.3 t -65.07 151.11 46.86 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 123.782 0.833 . . . . 62.109999999999999 112.16 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 89.9 p -65.48 -18.38 65.27 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.314 0.646 . . . . 64.040000000000006 111.812 176.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.425 ' HD2' ' N ' ' A' ' 37' ' ' LYS . 0.2 OUTLIER -77.83 -15.01 59.38 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.745 0.818 . . . . 65.430000000000007 111.936 175.859 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 90.0 m -77.63 -39.55 44.88 Favored 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 108.845 -0.798 . . . . 72.140000000000001 108.845 169.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -65.38 -30.25 71.05 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.045 0.938 . . . . 75.129999999999995 111.313 172.095 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.72 -35.84 65.15 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.454 0.702 . . . . 71.129999999999995 111.584 175.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 56.1 t80 -65.19 -42.39 93.65 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-O 121.47 0.653 . . . . 65.040000000000006 110.602 170.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.477 HD23 ' HD3' ' A' ' 45' ' ' LYS . 50.4 mt -64.94 -32.92 74.87 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.842 0.857 . . . . 64.310000000000002 111.543 175.638 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.7 -35.56 81.1 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.285 0.634 . . . . 61.439999999999998 111.535 174.083 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.71 -45.82 81.29 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.177 0.591 . . . . 60.439999999999998 112.07 177.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.477 ' HD3' HD23 ' A' ' 42' ' ' LEU . 18.0 ptmt -86.05 -22.99 26.93 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 112.938 0.718 . . . . 72.209999999999994 112.938 -174.282 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 92.3 mt -90.55 -10.66 42.67 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.217 0.607 . . . . 74.319999999999993 111.475 171.393 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.3 t70 64.7 36.62 8.09 Favored 'General case' 0 CA--C 1.567 1.608 0 C-N-CA 124.269 1.027 . . . . 61.43 111.525 176.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -133.23 -168.69 2.13 Favored 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 124.005 0.922 . . . . 71.510000000000005 111.996 -176.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -85.86 144.98 40.22 Favored Pre-proline 0 N--CA 1.492 1.642 0 C-N-CA 123.335 0.654 . . . . 72.430000000000007 111.334 175.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -61.33 -31.0 88.62 Favored 'Trans proline' 0 C--N 1.388 2.609 0 C-N-CA 122.911 2.407 . . . . 72.319999999999993 112.847 177.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -65.79 -37.13 85.47 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.062 0.945 . . . . 71.200000000000003 110.855 177.335 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.51 ' HB3' ' HZ2' ' A' ' 17' ' ' TRP . 75.2 mm-40 -75.5 -31.23 60.1 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.508 0.723 . . . . 71.0 112.187 179.193 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 94.8 t -63.32 -40.27 88.42 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 C-N-CA 122.827 0.451 . . . . 63.439999999999998 110.293 170.069 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 37.9 t -62.67 -39.46 94.01 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.387 0.675 . . . . 52.439999999999998 111.809 177.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -53.55 -53.75 47.15 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 121.315 0.579 . . . . 72.310000000000002 110.679 174.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 9.7 mmm180 -61.1 -41.69 97.14 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 114.634 -1.166 . . . . 72.5 112.919 -178.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 40.4 t80 -57.91 -51.12 70.94 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 124.029 0.932 . . . . 73.540000000000006 112.442 176.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 -74.64 -24.81 58.89 Favored 'General case' 0 CA--C 1.555 1.148 0 CA-C-N 115.775 -0.648 . . . . 74.120000000000005 111.744 -176.05 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 16.0 mm100 -75.47 -29.29 59.57 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.09 0.556 . . . . 75.439999999999998 110.692 170.068 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.616 HD11 ' HA ' ' A' ' 22' ' ' ASP . 9.8 mt -66.04 -41.75 90.47 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.827 0.851 . . . . 62.32 111.9 175.693 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 25.3 mmt . . . . . 0 N--CA 1.484 1.238 0 CA-C-O 121.198 0.523 . . . . 71.030000000000001 111.321 175.996 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 95.6 m95 . . . . . 0 N--CA 1.475 0.81 0 N-CA-C 110.374 -0.232 . . . . 74.340000000000003 110.374 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . 0.508 ' OG1' ' HB2' ' A' ' 21' ' ' ASP . 41.4 p -89.7 148.22 23.41 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 109.081 -0.711 . . . . 74.150000000000006 109.081 179.21 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -63.03 -20.09 64.99 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.28 0.632 . . . . 73.0 112.435 -172.44 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.461 ' O ' HG23 ' A' ' 24' ' ' VAL . 9.3 m120 -75.94 -47.09 26.55 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 123.507 0.723 . . . . 74.299999999999997 109.908 171.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.508 ' HB2' ' OG1' ' A' ' 18' ' ' THR . 0.4 OUTLIER -59.96 -55.79 29.76 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 125.208 1.403 . . . . 74.549999999999997 111.783 -173.563 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.565 ' HB2' HD21 ' A' ' 60' ' ' LEU . 1.6 p30 -64.49 -32.51 74.17 Favored 'General case' 0 CA--C 1.557 1.238 0 CA-C-N 115.735 -0.666 . . . . 73.430000000000007 112.573 179.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -64.58 -38.02 89.57 Favored 'General case' 0 CA--C 1.56 1.335 0 C-N-CA 123.011 0.524 . . . . 74.299999999999997 111.395 174.011 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.461 HG23 ' O ' ' A' ' 20' ' ' ASN . 99.1 t -67.69 -32.14 55.48 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 C-N-CA 123.182 0.593 . . . . 74.329999999999998 111.239 176.262 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 91.5 mt -56.6 -54.91 23.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 C-N-CA 122.238 0.215 . . . . 71.340000000000003 110.907 173.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.502 ' HG ' HD13 ' A' ' 60' ' ' LEU . 98.7 mt -57.8 -44.07 86.08 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 123.394 0.678 . . . . 71.099999999999994 111.757 176.184 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 39.5 tp -60.57 -49.46 77.46 Favored 'General case' 0 CA--C 1.561 1.397 0 C-N-CA 124.286 1.034 . . . . 62.520000000000003 112.452 -177.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -77.78 -20.35 53.47 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.575 0.75 . . . . 72.120000000000005 112.539 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 69.4 m -74.12 -29.27 61.75 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-O 120.846 0.355 . . . . 73.420000000000002 110.732 170.33 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 91.7 mt-30 -75.41 -19.58 59.43 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.215 0.606 . . . . 72.439999999999998 111.42 170.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 35.8 ttmt -82.88 -69.76 0.6 Allowed 'General case' 0 CA--C 1.559 1.302 0 C-N-CA 123.512 0.725 . . . . 75.230000000000004 111.407 173.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 51.6 mtp180 -81.07 -42.14 21.49 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.582 0.753 . . . . 74.430000000000007 112.699 -174.377 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 122.74 161.08 11.11 Favored Glycine 0 CA--C 1.54 1.609 0 CA-C-O 119.711 -0.494 . . . . 63.310000000000002 112.784 -175.335 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -69.27 92.66 0.47 Allowed 'Trans proline' 0 C--N 1.374 1.901 0 C-N-CA 122.608 2.206 . . . . 61.100000000000001 111.914 173.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 43.6 t -148.47 157.74 43.66 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 123.084 0.554 . . . . 61.020000000000003 112.287 -174.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 95.4 p -63.63 -29.54 70.77 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 123.569 0.747 . . . . 75.150000000000006 111.092 175.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -63.57 -34.88 78.78 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.772 0.829 . . . . 64.109999999999999 111.019 175.174 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 21.5 m -82.94 -33.32 26.78 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 115.249 -0.887 . . . . 71.109999999999999 110.054 -177.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -68.63 -38.17 80.29 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.372 0.669 . . . . 54.32 111.104 175.474 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.35 -35.3 75.74 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.378 0.671 . . . . 61.340000000000003 111.275 174.252 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -66.43 -47.71 72.33 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 123.522 0.729 . . . . 65.239999999999995 111.435 177.08 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.412 ' HB2' HG11 ' A' ' 53' ' ' VAL . 25.9 mt -69.17 -24.22 64.03 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.49 1.116 . . . . 73.540000000000006 111.986 176.347 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.51 -47.34 82.11 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-O 121.091 0.472 . . . . 73.319999999999993 110.601 170.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -68.09 -39.69 82.81 Favored 'General case' 0 CA--C 1.557 1.213 0 C-N-CA 123.588 0.755 . . . . 71.540000000000006 112.058 177.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 32.3 ttmt -73.94 -36.51 64.66 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 124.094 0.958 . . . . 52.439999999999998 112.223 -176.568 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 82.6 mt -108.27 9.56 27.94 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 112.882 0.697 . . . . 73.439999999999998 112.882 -174.202 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 66.71 11.73 8.38 Favored 'General case' 0 N--CA 1.503 2.194 0 C-N-CA 124.73 1.212 . . . . 64.549999999999997 112.944 -179.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm -91.65 -163.99 1.12 Allowed 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 124.068 0.947 . . . . 74.099999999999994 112.049 -175.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -124.81 149.75 63.64 Favored Pre-proline 0 CA--C 1.567 1.63 0 C-N-CA 124.087 0.955 . . . . 74.209999999999994 109.212 174.464 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -48.68 -44.22 31.68 Favored 'Trans proline' 0 C--N 1.391 2.769 0 C-N-CA 123.782 2.988 . . . . 71.530000000000001 115.755 -173.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -68.51 -35.22 77.18 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 122.51 0.324 . . . . 73.430000000000007 111.315 -179.279 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 -62.69 -45.97 90.34 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 123.345 0.658 . . . . 74.200000000000003 111.076 175.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.412 HG11 ' HB2' ' A' ' 42' ' ' LEU . 98.8 t -62.2 -40.7 88.6 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.04 0 CA-C-N 115.503 -0.771 . . . . 54.310000000000002 111.252 176.525 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.0 t -68.71 -45.13 72.38 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.902 0.881 . . . . 74.219999999999999 112.765 -175.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -64.88 -42.16 95.06 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 122.694 0.398 . . . . 73.150000000000006 110.878 178.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 22.3 tpt180 -66.39 -39.34 88.99 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 122.592 0.357 . . . . 70.510000000000005 110.785 177.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 34.4 t80 -51.24 -53.13 38.3 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 124.57 1.148 . . . . 73.219999999999999 112.371 178.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -73.66 -23.09 59.8 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 112.72 0.637 . . . . 74.340000000000003 112.72 -177.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -75.88 -26.0 56.65 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 123.208 0.603 . . . . 74.150000000000006 110.783 172.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.565 HD21 ' HB2' ' A' ' 22' ' ' ASP . 42.1 mt -74.6 -40.72 61.41 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.818 0.847 . . . . 75.230000000000004 110.98 171.587 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 84.0 mtp . . . . . 0 N--CA 1.479 1.018 0 C-N-CA 123.436 0.694 . . . . 62.329999999999998 111.202 176.54 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . 0.446 ' CH2' ' HG3' ' A' ' 48' ' ' LYS . 99.0 m95 . . . . . 0 C--O 1.241 0.609 0 N-CA-C 110.04 -0.356 . . . . 71.530000000000001 110.04 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 21.7 p -111.72 164.28 13.21 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 108.551 -0.907 . . . . 53.420000000000002 108.551 174.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 27.3 ptt-85 -57.59 -19.84 28.49 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.305 0.642 . . . . 51.119999999999997 112.465 178.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.444 ' O ' HG23 ' A' ' 24' ' ' VAL . 28.0 m-80 -70.86 -49.31 47.44 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.45 0.7 . . . . 64.409999999999997 110.754 174.556 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -62.24 -57.05 12.86 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.676 0.79 . . . . 71.239999999999995 112.272 -176.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.462 ' HB2' HD11 ' A' ' 60' ' ' LEU . 2.2 p30 -64.68 -31.89 73.31 Favored 'General case' 0 CA--C 1.555 1.162 0 C-N-CA 123.335 0.654 . . . . 72.310000000000002 112.399 -176.285 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -62.75 -39.24 93.54 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.557 0.743 . . . . 74.400000000000006 111.821 174.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 20' ' ' ASN . 62.4 t -65.61 -38.45 82.37 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 C-N-CA 122.969 0.508 . . . . 62.43 110.577 174.437 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 70.5 mt -59.87 -47.16 92.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 CA-C-O 120.96 0.409 . . . . 71.409999999999997 110.951 174.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.44 HD11 HD22 ' A' ' 60' ' ' LEU . 88.9 mt -62.86 -36.81 84.5 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.201 1.0 . . . . 54.329999999999998 112.09 178.255 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 53.5 tp -67.71 -53.85 24.22 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.339 0.656 . . . . 73.140000000000001 111.289 178.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.51 ' HA ' ' HB3' ' A' ' 31' ' ' LYS . 8.2 mm-40 -71.12 -20.78 62.28 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.737 0.815 . . . . 74.040000000000006 112.426 -176.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 35.7 t -67.05 -30.97 71.18 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.091 0.557 . . . . 53.450000000000003 111.699 171.316 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 24.3 mm-40 -96.86 -23.69 16.24 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.0 0.52 . . . . 74.349999999999994 111.501 177.598 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.51 ' HB3' ' HA ' ' A' ' 28' ' ' GLU . 58.6 tptt -76.17 -58.01 3.53 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.896 0.879 . . . . 71.209999999999994 110.649 179.37 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -90.82 -60.27 1.96 Allowed 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.641 0.777 . . . . 74.239999999999995 109.818 176.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 148.15 178.94 23.72 Favored Glycine 0 CA--C 1.536 1.375 0 CA-C-N 115.11 -0.95 . . . . 65.120000000000005 112.285 -175.245 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -82.83 35.77 0.59 Allowed 'Trans proline' 0 CA--C 1.562 1.906 0 C-N-CA 123.21 2.606 . . . . 64.329999999999998 112.762 174.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 30.3 t -72.36 145.54 47.68 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.959 0.904 . . . . 44.420000000000002 111.455 -179.342 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 80.2 p -61.3 -31.93 71.77 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.317 0.647 . . . . 74.5 111.311 173.365 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.1 tmtm? -65.34 -33.68 76.55 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 124.406 1.082 . . . . 75.140000000000001 110.889 174.657 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 56.2 m -75.04 -38.99 61.27 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.344 0.658 . . . . 45.409999999999997 109.786 -179.116 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 28.1 m-85 -67.26 -32.48 73.53 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 123.527 0.731 . . . . 71.409999999999997 112.066 174.46 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.14 -34.68 66.23 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.598 0.759 . . . . 64.549999999999997 111.324 174.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -63.0 -48.81 77.22 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 123.587 0.755 . . . . 72.319999999999993 110.536 172.277 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.458 ' HB2' HG11 ' A' ' 53' ' ' VAL . 44.4 mt -64.94 -29.31 70.24 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 124.644 1.178 . . . . 75.030000000000001 112.226 177.415 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.76 -50.53 68.69 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.13 0.572 . . . . 55.520000000000003 110.993 171.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.1 -27.6 62.75 Favored 'General case' 0 CA--C 1.558 1.282 0 C-N-CA 123.16 0.584 . . . . 72.099999999999994 112.368 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.53 -51.76 11.08 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.809 0.844 . . . . 55.520000000000003 109.959 -178.593 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 63.5 mt -87.1 2.53 49.46 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.872 0.869 . . . . 63.039999999999999 111.897 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 62.29 24.02 14.26 Favored 'General case' 0 N--CA 1.497 1.913 0 C-N-CA 124.67 1.188 . . . . 71.310000000000002 113.035 178.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.446 ' HG3' ' CH2' ' A' ' 17' ' ' TRP . 72.2 mmtt -96.94 -167.62 1.58 Allowed 'General case' 0 CA--C 1.558 1.252 0 C-N-CA 124.948 1.299 . . . . 73.430000000000007 111.144 177.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.435 HD22 ' NE2' ' A' ' 52' ' ' GLN . 24.8 m-80 -105.81 144.55 29.12 Favored Pre-proline 0 N--CA 1.492 1.631 0 C-N-CA 123.683 0.793 . . . . 75.230000000000004 110.376 175.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -63.32 -29.8 72.9 Favored 'Trans proline' 0 C--N 1.384 2.417 0 C-N-CA 122.794 2.329 . . . . 63.039999999999999 113.037 -175.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -61.12 -49.69 76.23 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.014 0.926 . . . . 73.209999999999994 110.334 174.748 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.467 ' O ' ' HG2' ' A' ' 56' ' ' ARG . 76.3 mt-30 -55.4 -55.64 29.36 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 115.391 -0.822 . . . . 75.439999999999998 111.492 176.719 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.458 HG11 ' HB2' ' A' ' 42' ' ' LEU . 84.6 t -55.98 -45.79 80.3 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.305 0 C-N-CA 124.036 0.934 . . . . 43.310000000000002 112.468 -174.35 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 32.8 t -61.39 -43.84 98.18 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.377 0.671 . . . . 64.109999999999999 111.698 178.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -65.89 -44.93 83.8 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.352 0.661 . . . . 73.219999999999999 111.801 178.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.467 ' HG2' ' O ' ' A' ' 52' ' ' GLN . 2.4 mmp_? -65.71 -35.82 81.85 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 122.492 0.317 . . . . 74.120000000000005 111.094 -176.35 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.518 ' HA ' HD12 ' A' ' 60' ' ' LEU . 17.0 t80 -53.77 -49.86 67.3 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.959 0.904 . . . . 60.25 111.708 172.241 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -71.8 -25.0 61.82 Favored 'General case' 0 CA--C 1.552 1.034 0 CA-C-N 115.506 -0.77 . . . . 74.299999999999997 111.64 -176.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -76.29 -39.4 54.31 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.033 0.533 . . . . 70.030000000000001 110.527 173.017 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.518 HD12 ' HA ' ' A' ' 57' ' ' PHE . 16.3 mt -54.26 -46.34 72.61 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 124.712 1.205 . . . . 74.209999999999994 111.563 177.27 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 31.7 mmt . . . . . 0 N--CA 1.485 1.293 0 C-N-CA 123.77 0.828 . . . . 60.130000000000003 111.498 175.946 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . 0.474 ' HZ2' ' HB3' ' A' ' 52' ' ' GLN . 96.7 m95 . . . . . 0 N--CA 1.484 1.257 0 N-CA-C 111.407 0.151 . . . . 75.450000000000003 111.407 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 25.9 p -103.17 164.6 11.52 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 120.979 0.419 . . . . 75.5 111.111 177.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.46 ' HA ' ' HE ' ' A' ' 19' ' ' ARG . 0.4 OUTLIER -60.34 -21.89 62.6 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.965 0.906 . . . . 73.25 112.377 -177.715 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -74.97 -49.51 19.76 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 123.739 0.816 . . . . 61.43 110.902 176.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 59.9 m-20 -59.82 -53.32 59.32 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 123.471 0.708 . . . . 71.219999999999999 112.092 -175.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.601 ' HB2' HD21 ' A' ' 60' ' ' LEU . 2.9 p30 -62.66 -32.42 73.47 Favored 'General case' 0 CA--C 1.561 1.372 0 CA-C-N 115.371 -0.832 . . . . 61.109999999999999 112.216 -177.579 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 35.7 ttm180 -70.54 -40.39 73.44 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.764 0.825 . . . . 73.040000000000006 111.57 176.758 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 45.8 t -61.81 -39.6 84.01 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.344 0 C-N-CA 123.665 0.786 . . . . 74.409999999999997 111.22 175.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 90.8 mt -56.24 -53.96 33.41 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 C-N-CA 123.206 0.602 . . . . 64.430000000000007 111.219 174.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 96.5 mt -62.49 -46.85 86.57 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.267 0.627 . . . . 75.150000000000006 112.18 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 49.1 tp -61.89 -50.3 72.75 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.973 0.909 . . . . 71.530000000000001 112.145 -174.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.522 ' HB2' HD21 ' A' ' 42' ' ' LEU . 31.1 mt-10 -76.85 -18.27 58.47 Favored 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 112.757 0.651 . . . . 74.230000000000004 112.757 -179.01 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 61.9 m -70.02 -29.43 66.48 Favored 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 122.508 0.323 . . . . 63.439999999999998 111.108 165.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 -83.7 -20.58 33.25 Favored 'General case' 0 N--CA 1.492 1.626 0 C-N-CA 122.901 0.481 . . . . 74.450000000000003 111.984 174.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -74.05 -44.72 53.28 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 122.996 0.519 . . . . 73.209999999999994 110.422 171.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 73.9 mtp180 -108.83 -70.98 0.78 Allowed 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.641 0.776 . . . . 75.209999999999994 111.954 -173.202 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 155.62 147.57 4.76 Favored Glycine 0 CA--C 1.54 1.617 0 CA-C-O 119.059 -0.856 . . . . 34.119999999999997 112.197 -175.292 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -65.67 86.2 0.22 Allowed 'Trans proline' 0 C--N 1.378 2.116 0 C-N-CA 123.234 2.623 . . . . 71.25 112.622 175.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 29.3 t -130.26 155.36 46.42 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 124.023 0.929 . . . . 62.43 110.818 -177.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 81.9 p -66.89 -29.41 69.3 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.259 0.623 . . . . 65.5 111.671 176.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -68.26 -32.06 71.97 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.148 0.579 . . . . 72.540000000000006 110.849 172.258 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 66.8 m -79.79 -33.51 40.47 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.218 0.607 . . . . 70.310000000000002 109.604 -179.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -69.43 -32.77 71.94 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.396 0.678 . . . . 73.510000000000005 111.048 173.195 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.8 -35.2 72.43 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.533 0.733 . . . . 75.120000000000005 111.287 173.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -62.93 -50.57 70.3 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.478 0.711 . . . . 73.109999999999999 111.121 172.075 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.522 HD21 ' HB2' ' A' ' 28' ' ' GLU . 54.8 mt -66.44 -23.38 66.28 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 124.411 1.085 . . . . 60.130000000000003 111.894 178.697 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.12 -45.99 82.83 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.15 0.58 . . . . 65.109999999999999 111.166 169.412 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.1 -32.56 65.05 Favored 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 123.347 0.659 . . . . 71.349999999999994 111.953 176.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.45 ' HB3' ' HA ' ' A' ' 42' ' ' LEU . 23.8 tptp -76.92 -34.24 57.69 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.906 1.282 . . . . 73.030000000000001 111.677 -173.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 92.2 mt -102.82 -5.24 23.84 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 123.73 0.812 . . . . 65.319999999999993 112.14 175.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.3 t70 65.2 31.53 10.72 Favored 'General case' 0 CA--C 1.574 1.883 0 C-N-CA 124.583 1.153 . . . . 70.400000000000006 111.215 -178.162 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -110.03 -177.2 3.19 Favored 'General case' 0 N--CA 1.495 1.812 0 C-N-CA 124.53 1.132 . . . . 75.319999999999993 111.984 -178.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -85.98 140.98 35.13 Favored Pre-proline 0 N--CA 1.489 1.489 0 C-N-CA 123.293 0.637 . . . . 72.409999999999997 110.853 173.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -66.63 -24.68 47.84 Favored 'Trans proline' 0 C--N 1.38 2.222 0 C-N-CA 122.4 2.067 . . . . 44.240000000000002 113.039 -177.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -67.34 -47.05 71.64 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.522 0.729 . . . . 64.030000000000001 110.186 173.293 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.474 ' HB3' ' HZ2' ' A' ' 17' ' ' TRP . 84.2 mm-40 -60.62 -32.5 71.64 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.695 0.798 . . . . 55.219999999999999 112.081 177.112 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.479 HG11 ' HB2' ' A' ' 42' ' ' LEU . 88.8 t -74.95 -45.12 43.9 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.224 0 C-N-CA 123.859 0.864 . . . . 64.010000000000005 111.681 177.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 87.4 p -63.91 -42.51 97.38 Favored 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 123.1 0.56 . . . . 74.230000000000004 111.318 -179.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -60.61 -41.29 94.47 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.714 0.805 . . . . 73.5 111.432 172.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 1.2 tpp180 -64.16 -42.86 96.56 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 122.985 0.514 . . . . 74.329999999999998 111.736 -174.023 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -51.38 -48.65 62.48 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 124.002 0.921 . . . . 73.439999999999998 111.626 173.271 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -73.27 -32.52 64.71 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-N 115.551 -0.75 . . . . 75.239999999999995 112.301 -174.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 17.6 mm-40 -70.94 -41.76 70.71 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.296 0.638 . . . . 74.209999999999994 110.479 175.24 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.601 HD21 ' HB2' ' A' ' 22' ' ' ASP . 7.5 mt -53.11 -44.11 67.38 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 124.908 1.283 . . . . 62.130000000000003 112.787 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 31.6 mmt . . . . . 0 CA--C 1.558 1.288 0 O-C-N 123.962 0.789 . . . . 74.530000000000001 111.11 177.075 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 85.1 m95 . . . . . 0 N--CA 1.478 0.959 0 N-CA-C 109.869 -0.419 . . . . 71.25 109.869 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 24.8 p -98.47 156.61 16.69 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 109.293 -0.632 . . . . 52.219999999999999 109.293 176.06 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 6.3 ptm180 -58.47 -21.16 50.6 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 113.869 1.062 . . . . 73.439999999999998 113.869 -173.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.445 ' O ' HG23 ' A' ' 24' ' ' VAL . 3.6 t-20 -74.32 -49.16 24.1 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 122.784 0.433 . . . . 73.129999999999995 110.403 176.582 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.6 -58.09 9.57 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.24 1.016 . . . . 74.230000000000004 113.287 -177.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.577 ' HB2' HD11 ' A' ' 60' ' ' LEU . 3.0 p30 -63.36 -31.73 72.97 Favored 'General case' 0 CA--C 1.56 1.342 0 C-N-CA 122.748 0.419 . . . . 63.229999999999997 111.914 -177.752 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 42.7 ttt-85 -64.97 -35.48 81.32 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 123.261 0.624 . . . . 72.239999999999995 111.541 174.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.445 HG23 ' O ' ' A' ' 20' ' ' ASN . 90.2 t -70.77 -33.77 53.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 C-N-CA 123.276 0.631 . . . . 44.329999999999998 111.017 174.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 95.0 mt -57.93 -46.99 87.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 CA-C-O 120.707 0.289 . . . . 71.5 110.419 172.503 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.638 HD21 ' HB3' ' A' ' 60' ' ' LEU . 96.1 mt -60.77 -38.5 85.48 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.845 0.858 . . . . 71.549999999999997 112.313 176.392 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 40.4 tp -68.9 -47.44 65.8 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.462 0.705 . . . . 71.239999999999995 111.733 -179.434 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -75.69 -23.59 56.19 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.301 0.64 . . . . 74.239999999999995 111.913 -179.19 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.455 ' SG ' ' HE1' ' A' ' 57' ' ' PHE . 34.7 t -64.76 -31.03 72.07 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.417 0.687 . . . . 74.239999999999995 111.284 171.816 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -88.58 -31.53 18.57 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.467 0.707 . . . . 73.109999999999999 111.648 176.222 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -78.63 -70.17 0.51 Allowed 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.0 0.52 . . . . 61.140000000000001 111.105 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 7.2 mpt_? -70.46 -28.62 65.15 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.688 0.795 . . . . 73.409999999999997 112.102 178.569 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.16 167.8 35.87 Favored Glycine 0 CA--C 1.536 1.348 0 CA-C-O 119.493 -0.615 . . . . 63.200000000000003 112.579 -175.491 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_exo -72.62 87.72 0.94 Allowed 'Trans proline' 0 C--N 1.373 1.841 0 C-N-CA 122.606 2.204 . . . . 65.540000000000006 111.956 175.022 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.8 t -135.56 158.36 44.59 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.356 0.662 . . . . 72.219999999999999 111.515 -177.509 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 64.4 p -63.65 -38.66 91.96 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.701 0.8 . . . . 74.140000000000001 111.863 177.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 57.8 pttt -73.55 -11.15 60.35 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 123.283 0.633 . . . . 70.420000000000002 112.382 177.253 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 56.6 m -78.36 -40.38 36.52 Favored 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 108.97 -0.752 . . . . 73.120000000000005 108.97 174.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 49.1 m-85 -65.91 -33.37 75.67 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.673 0.789 . . . . 73.129999999999995 111.145 173.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.82 -41.46 83.04 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.361 0.664 . . . . 62.130000000000003 111.39 174.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -62.07 -50.4 72.1 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 122.883 0.473 . . . . 75.019999999999996 110.59 173.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.402 ' HA ' ' HB3' ' A' ' 45' ' ' LYS . 59.4 mt -63.33 -23.71 67.54 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 124.84 1.256 . . . . 72.230000000000004 112.7 178.627 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . 0.556 ' HA ' ' O ' ' A' ' 48' ' ' LYS . . . -65.59 -50.85 63.6 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.135 0.574 . . . . 73.150000000000006 111.45 173.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.79 -28.26 61.56 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-N 115.907 -0.588 . . . . 53.530000000000001 111.956 176.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.402 ' HB3' ' HA ' ' A' ' 42' ' ' LEU . 23.1 tptm -71.19 -47.38 57.84 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 124.403 1.081 . . . . 63.32 111.585 -176.46 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 75.7 mt -107.34 -0.22 22.6 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.754 0.822 . . . . 71.019999999999996 112.701 -172.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 62.0 33.57 17.2 Favored 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 124.571 1.148 . . . . 73.329999999999998 112.074 -176.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.556 ' O ' ' HA ' ' A' ' 43' ' ' ALA . 45.6 mmtm -126.48 116.22 20.78 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.811 0.845 . . . . 73.140000000000001 109.573 -178.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -48.3 148.43 3.26 Favored Pre-proline 0 N--CA 1.502 2.14 0 C-N-CA 123.691 0.797 . . . . 73.319999999999993 112.954 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -53.82 -31.67 63.07 Favored 'Trans proline' 0 C--N 1.387 2.557 0 C-N-CA 123.285 2.657 . . . . 74.510000000000005 115.041 -168.224 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 25.3 m-80 -63.62 -38.87 92.74 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 123.154 0.582 . . . . 74.340000000000003 111.511 178.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -62.41 -43.09 99.65 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.971 0.908 . . . . 75.310000000000002 110.229 178.21 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 57.6 t -68.81 -42.68 82.86 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.982 0 CA-C-N 114.261 -1.336 . . . . 75.329999999999998 111.716 -177.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 58.0 m -64.19 -36.36 83.79 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.996 0.918 . . . . 54.009999999999998 112.789 -177.05 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -63.58 -46.8 84.19 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 122.797 0.439 . . . . 72.319999999999993 111.084 175.063 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 17.2 mmt180 -70.67 -27.76 64.27 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 112.708 0.632 . . . . 75.319999999999993 112.708 178.227 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.455 ' HE1' ' SG ' ' A' ' 29' ' ' CYS . 22.8 t80 -56.38 -55.52 32.49 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.078 0.551 . . . . 72.540000000000006 110.735 175.162 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -71.69 -25.99 62.32 Favored 'General case' 0 CA--C 1.554 1.111 0 CA-C-N 115.232 -0.895 . . . . 70.099999999999994 111.637 -178.502 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -72.39 -38.87 68.36 Favored 'General case' 0 CA--C 1.556 1.19 0 C-N-CA 124.818 1.247 . . . . 74.319999999999993 109.684 179.198 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.638 ' HB3' HD21 ' A' ' 26' ' ' LEU . 44.3 mt -73.98 -37.43 64.48 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.758 1.223 . . . . 72.030000000000001 111.716 177.612 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 29.4 mmt . . . . . 0 N--CA 1.487 1.398 0 C-N-CA 122.909 0.484 . . . . 65.340000000000003 111.436 174.93 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 90.3 m95 . . . . . 0 CA--C 1.542 0.651 0 N-CA-C 109.907 -0.405 . . . . 74.340000000000003 109.907 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 37.7 p -103.53 167.37 9.85 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.262 0.625 . . . . 62.409999999999997 111.597 -175.22 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.447 ' O ' ' HB2' ' A' ' 23' ' ' ARG . 16.5 ptm180 -62.28 -21.49 65.26 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-N 115.268 -0.878 . . . . 70.540000000000006 112.303 174.575 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -77.66 -45.21 25.67 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 123.721 0.808 . . . . 71.310000000000002 110.842 174.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.471 ' HA ' HD22 ' A' ' 46' ' ' LEU . 76.7 m-20 -60.26 -58.84 6.8 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.051 0.54 . . . . 62.240000000000002 112.079 -176.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -66.87 -30.73 70.97 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 123.498 0.719 . . . . 75.329999999999998 111.704 -172.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.447 ' HB2' ' O ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -60.77 -49.61 76.82 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.993 0.917 . . . . 72.319999999999993 111.448 175.814 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 89.2 t -69.95 -32.18 50.62 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 CA-C-N 114.587 -1.188 . . . . 74.409999999999997 110.889 -179.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.403 ' HA ' HD13 ' A' ' 42' ' ' LEU . 66.4 mt -56.3 -56.28 14.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 C-N-CA 122.491 0.317 . . . . 54.450000000000003 110.7 172.852 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 96.0 mt -58.08 -45.4 87.22 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.317 0.647 . . . . 74.530000000000001 112.472 179.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 32.2 tp -64.92 -50.05 67.99 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.094 0.557 . . . . 71.230000000000004 112.274 -174.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -78.41 -23.26 46.81 Favored 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 123.033 0.533 . . . . 74.519999999999996 112.42 -178.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.491 ' HA ' HG21 ' A' ' 38' ' ' THR . 53.3 t -73.04 -31.46 64.45 Favored 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 122.933 0.493 . . . . 73.109999999999999 111.549 177.26 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -87.08 7.4 28.04 Favored 'General case' 0 N--CA 1.486 1.363 0 CA-C-O 120.668 0.27 . . . . 54.119999999999997 111.259 173.537 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.8 ttmp? -110.03 -53.27 2.69 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 123.871 0.868 . . . . 73.510000000000005 111.233 -178.424 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -100.86 9.14 42.7 Favored 'General case' 0 N--CA 1.497 1.889 0 C-N-CA 123.583 0.753 . . . . 73.430000000000007 112.22 177.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 87.88 160.39 35.62 Favored Glycine 0 CA--C 1.544 1.881 0 CA-C-O 119.944 -0.365 . . . . 74.340000000000003 113.75 -178.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.439 ' HA ' ' SG ' ' A' ' 29' ' ' CYS . 53.2 Cg_endo -84.9 40.51 0.84 Allowed 'Trans proline' 0 C--N 1.37 1.687 0 C-N-CA 123.247 2.631 . . . . 61.210000000000001 113.691 -177.743 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 47.4 m -107.43 171.64 7.27 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 123.614 0.765 . . . . 51.219999999999999 112.384 -175.03 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 88.7 p -61.58 -24.27 66.55 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 123.789 0.835 . . . . 74.120000000000005 112.776 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -49.66 -45.27 48.41 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 124.471 1.108 . . . . 74.439999999999998 111.68 170.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.491 HG21 ' HA ' ' A' ' 29' ' ' CYS . 17.7 m -88.35 -33.97 17.77 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 114.806 -1.088 . . . . 74.349999999999994 110.9 -173.758 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 -67.79 -35.48 78.74 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.004 0.521 . . . . 75.25 112.251 -179.813 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.2 -36.43 69.19 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.387 0.613 . . . . 42.240000000000002 111.411 174.37 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 20.9 t80 -59.69 -49.43 77.77 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 124.236 1.014 . . . . 73.010000000000005 111.463 172.361 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.483 ' HB2' HG11 ' A' ' 53' ' ' VAL . 59.8 mt -70.52 -26.28 63.51 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 124.308 1.043 . . . . 72.209999999999994 112.008 178.698 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.1 -56.32 22.27 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 122.892 0.477 . . . . 74.310000000000002 111.327 174.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.57 -28.64 68.69 Favored 'General case' 0 N--CA 1.485 1.296 0 N-CA-C 112.363 0.505 . . . . 62.530000000000001 112.363 178.143 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.5 tptp -69.96 -45.79 66.65 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.114 0.565 . . . . 74.019999999999996 112.104 178.209 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.555 ' HB2' ' HG2' ' A' ' 48' ' ' LYS . 28.8 mt -99.09 0.94 44.67 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.26 0.624 . . . . 73.120000000000005 112.153 -173.605 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 25.8 t70 69.45 26.98 5.06 Favored 'General case' 0 CA--C 1.569 1.709 0 C-N-CA 125.115 1.366 . . . . 74.349999999999994 111.831 -178.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.555 ' HG2' ' HB2' ' A' ' 46' ' ' LEU . 63.2 mmtt -101.8 -174.89 2.7 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 123.682 0.793 . . . . 45.439999999999998 111.458 179.258 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . 0.435 HD22 ' N ' ' A' ' 49' ' ' ASN . 0.8 OUTLIER -100.13 151.35 37.49 Favored Pre-proline 0 N--CA 1.49 1.557 0 C-N-CA 123.821 0.848 . . . . 71.219999999999999 109.285 167.909 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -61.83 -33.53 84.58 Favored 'Trans proline' 0 C--N 1.382 2.306 0 C-N-CA 122.721 2.281 . . . . 74.049999999999997 113.35 -176.102 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 -65.99 -39.19 90.1 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.666 0.786 . . . . 70.329999999999998 111.538 177.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -69.42 -38.72 78.02 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.489 0.716 . . . . 74.400000000000006 111.339 -179.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.483 HG11 ' HB2' ' A' ' 42' ' ' LEU . 95.0 t -65.42 -41.42 91.07 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 C-N-CA 123.436 0.694 . . . . 60.530000000000001 110.872 174.382 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.8 t -60.05 -42.33 94.23 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.563 0.745 . . . . 53.229999999999997 111.311 176.491 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -64.81 -49.6 70.01 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 115.837 -0.619 . . . . 75.219999999999999 111.547 175.024 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.47 ' O ' ' HB2' ' A' ' 60' ' ' LEU . 3.3 tpm_? -57.21 -41.98 80.43 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 122.998 0.519 . . . . 73.230000000000004 111.912 -178.002 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -59.07 -54.92 41.58 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.983 0.913 . . . . 72.329999999999998 112.24 177.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -73.35 -28.9 62.3 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.012 0.525 . . . . 74.450000000000003 111.95 -173.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 56.5 mt-30 -64.72 -46.14 83.55 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 122.947 0.499 . . . . 71.510000000000005 110.003 167.011 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.47 ' HB2' ' O ' ' A' ' 56' ' ' ARG . 0.8 OUTLIER -60.38 -38.35 83.66 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 124.256 1.022 . . . . 71.329999999999998 111.238 -177.6 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 21.7 mmt . . . . . 0 N--CA 1.481 1.107 0 C-N-CA 123.276 0.631 . . . . 55.140000000000001 111.869 176.973 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . 0.549 ' HE1' ' HG3' ' A' ' 56' ' ' ARG . 98.6 m95 . . . . . 0 N--CA 1.482 1.167 0 CA-C-O 120.835 0.35 . . . . 62.420000000000002 110.434 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 14.0 p -103.8 160.91 14.38 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 108.382 -0.97 . . . . 61.25 108.382 164.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 36.7 ptt-85 -57.0 -26.05 59.58 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 123.309 0.644 . . . . 73.310000000000002 111.886 177.352 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.438 ' O ' HG23 ' A' ' 24' ' ' VAL . 22.3 m-80 -75.52 -37.25 60.21 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.016 0.927 . . . . 75.450000000000003 110.911 -179.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -68.37 -47.71 66.68 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 112.961 0.726 . . . . 64.219999999999999 112.961 -177.487 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -65.54 -30.36 71.1 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 120.872 0.368 . . . . 72.030000000000001 111.38 176.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -62.32 -44.29 96.84 Favored 'General case' 0 N--CA 1.484 1.226 0 CA-C-N 116.421 -0.354 . . . . 73.040000000000006 111.053 168.717 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 20' ' ' ASN . 68.1 t -63.17 -34.28 65.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 C-N-CA 123.351 0.66 . . . . 74.030000000000001 111.169 176.676 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 88.0 mt -61.32 -44.03 97.7 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.502 0 C-N-CA 122.581 0.353 . . . . 72.230000000000004 111.222 173.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.442 ' HG ' HD13 ' A' ' 60' ' ' LEU . 94.0 mt -72.19 -28.53 63.26 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.609 0.764 . . . . 72.140000000000001 112.537 174.644 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 47.5 tp -68.01 -52.01 40.53 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 124.211 1.004 . . . . 53.520000000000003 110.325 178.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -76.97 -16.21 59.41 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 114.922 -1.035 . . . . 64.430000000000007 112.018 178.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 46.1 t -60.61 -32.85 71.97 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 123.076 0.55 . . . . 74.430000000000007 111.842 167.131 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 9.6 mm100 -91.14 -18.21 24.86 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 122.686 0.394 . . . . 75.010000000000005 110.973 176.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.403 ' HG3' ' NH1' ' A' ' 32' ' ' ARG . 54.1 tptt -74.67 -34.15 62.62 Favored 'General case' 0 CA--C 1.559 1.307 0 C-N-CA 124.09 0.956 . . . . 74.010000000000005 110.801 174.15 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.403 ' NH1' ' HG3' ' A' ' 31' ' ' LYS . 2.8 mpt_? -126.14 -73.77 0.62 Allowed 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.81 0.844 . . . . 74.129999999999995 110.561 174.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 150.37 167.33 14.31 Favored Glycine 0 N--CA 1.479 1.566 0 CA-C-O 119.056 -0.858 . . . . 52.219999999999999 111.574 -172.062 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.27 74.89 2.46 Favored 'Trans proline' 0 CA--C 1.564 1.991 0 CA-C-N 120.49 2.145 . . . . 72.409999999999997 112.363 173.138 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 42.5 t -123.38 164.18 19.36 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 124.302 1.041 . . . . 74.519999999999996 111.671 -173.211 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 79.8 p -62.94 -40.62 98.22 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 124.391 1.076 . . . . 64.25 111.621 179.531 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -66.25 -25.76 67.04 Favored 'General case' 0 N--CA 1.485 1.315 0 CA-C-N 115.541 -0.754 . . . . 62.439999999999998 112.072 176.075 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 20.8 m -83.87 -32.24 25.3 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.388 0.675 . . . . 74.510000000000005 110.394 -177.092 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -61.23 -40.22 93.2 Favored 'General case' 0 CA--C 1.555 1.156 0 C-N-CA 122.84 0.456 . . . . 74.219999999999999 110.304 170.374 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.71 -34.72 62.66 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.04 0.936 . . . . 73.299999999999997 111.957 177.479 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -64.84 -46.26 82.65 Favored 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 124.19 0.996 . . . . 73.540000000000006 110.989 177.19 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.476 ' HB2' HG11 ' A' ' 53' ' ' VAL . 42.7 mt -73.61 -25.61 60.41 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.417 1.087 . . . . 53.409999999999997 112.259 175.42 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.91 -42.64 94.56 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-O 120.872 0.368 . . . . 72.120000000000005 110.576 171.027 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -71.07 -36.93 72.45 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.682 0.793 . . . . 51.420000000000002 112.133 176.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 9.0 tmtm? -77.1 -41.62 41.37 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.908 0.883 . . . . 53.210000000000001 111.583 -174.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.434 ' HB3' ' HZ3' ' A' ' 17' ' ' TRP . 83.8 mt -99.6 -1.6 37.74 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.482 0.713 . . . . 53.340000000000003 112.02 -176.328 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 36.7 t70 55.58 65.2 1.53 Allowed 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 124.868 1.267 . . . . 73.420000000000002 112.815 179.43 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.44 ' HG3' ' CH2' ' A' ' 17' ' ' TRP . 68.1 mmtt -141.48 175.86 9.34 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 124.864 1.265 . . . . 51.240000000000002 109.922 172.643 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 65.2 m-80 -75.23 149.59 84.72 Favored Pre-proline 0 CA--C 1.559 1.291 0 N-CA-C 110.158 -0.312 . . . . 74.109999999999999 110.158 168.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -54.86 -29.66 64.39 Favored 'Trans proline' 0 C--N 1.387 2.571 0 C-N-CA 122.998 2.465 . . . . 64.099999999999994 114.482 -178.256 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -65.16 -41.02 95.08 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 123.612 0.765 . . . . 74.219999999999999 111.561 176.539 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 76.7 mm-40 -64.89 -36.79 85.51 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.427 0.691 . . . . 72.430000000000007 111.179 -176.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.476 HG11 ' HB2' ' A' ' 42' ' ' LEU . 82.4 t -72.51 -50.78 32.51 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.951 0 CA-C-N 115.161 -0.927 . . . . 71.099999999999994 111.045 172.391 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 46.6 t -60.16 -49.47 77.49 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 124.388 1.075 . . . . 62.520000000000003 112.884 -169.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.45 ' O ' ' HG2' ' A' ' 59' ' ' GLN . 31.4 mm-40 -56.51 -47.71 78.76 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.412 0.685 . . . . 62.049999999999997 111.833 177.703 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.549 ' HG3' ' HE1' ' A' ' 17' ' ' TRP . 10.1 mmm180 -71.91 -28.15 63.29 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.731 0.812 . . . . 74.200000000000003 112.843 -179.125 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -66.87 -41.29 87.51 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 108.716 -0.846 . . . . 65.549999999999997 108.716 173.302 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 53.4 mt-30 -69.33 -29.65 67.53 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 115.356 -0.838 . . . . 72.239999999999995 111.642 175.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . 0.45 ' HG2' ' O ' ' A' ' 55' ' ' GLU . 13.3 mm100 -66.99 -41.58 86.5 Favored 'General case' 0 N--CA 1.49 1.57 0 CA-C-O 121.203 0.525 . . . . 72.140000000000001 109.832 176.071 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.442 HD13 ' HG ' ' A' ' 26' ' ' LEU . 69.2 mt -59.57 -43.76 93.5 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 114.989 -1.005 . . . . 74.439999999999998 111.059 174.225 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 23.6 mmt . . . . . 0 N--CA 1.49 1.529 0 C-N-CA 123.266 0.626 . . . . 64.319999999999993 112.325 176.828 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 80.8 m95 . . . . . 0 N--CA 1.48 1.03 0 CA-C-O 121.093 0.473 . . . . 74.230000000000004 111.434 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 58.2 p -107.58 166.11 10.92 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.333 0.653 . . . . 44.520000000000003 110.949 177.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 17.1 ptp180 -57.91 -21.16 42.09 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 124.198 0.999 . . . . 72.109999999999999 112.276 174.015 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -76.58 -46.04 27.86 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 124.084 0.954 . . . . 60.030000000000001 110.724 174.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 39.2 m-20 -59.7 -57.03 14.67 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.25 0.62 . . . . 75.219999999999999 111.735 178.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.629 ' HB2' HD21 ' A' ' 60' ' ' LEU . 2.6 p30 -64.97 -31.74 73.13 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 113.209 0.818 . . . . 73.299999999999997 113.209 -174.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 48.2 ttt180 -62.28 -42.11 99.06 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 122.893 0.477 . . . . 73.519999999999996 111.018 175.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.463 ' HB ' HD21 ' A' ' 46' ' ' LEU . 92.7 t -71.36 -33.09 48.95 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 C-N-CA 123.455 0.702 . . . . 72.109999999999999 111.487 177.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 94.5 mt -57.65 -57.38 10.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 CA-C-O 120.886 0.374 . . . . 64.310000000000002 110.278 172.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.436 ' HG ' HD13 ' A' ' 60' ' ' LEU . 90.6 mt -61.89 -33.28 73.94 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 115.636 -0.711 . . . . 71.209999999999994 112.174 178.656 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 56.0 tp -61.76 -54.46 42.08 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.803 0.841 . . . . 71.319999999999993 111.533 179.047 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.524 ' HA ' ' HB3' ' A' ' 31' ' ' LYS . 59.3 mm-40 -75.13 -22.94 57.85 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 113.045 0.757 . . . . 75.230000000000004 113.045 -178.679 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 89.6 m -69.83 -30.13 67.56 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 122.775 0.43 . . . . 54.109999999999999 111.307 171.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -91.92 -20.38 21.47 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.346 0.658 . . . . 71.25 111.882 173.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.524 ' HB3' ' HA ' ' A' ' 28' ' ' GLU . 58.8 tptt -80.66 -67.21 0.79 Allowed 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.641 0.777 . . . . 73.099999999999994 110.545 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 45.2 mtt85 -92.51 -40.38 10.85 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.03 0.932 . . . . 72.030000000000001 111.74 -178.34 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 138.48 163.07 9.43 Favored Glycine 0 N--CA 1.481 1.658 0 CA-C-O 119.528 -0.596 . . . . 52.140000000000001 112.556 -178.384 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -83.2 36.37 0.61 Allowed 'Trans proline' 0 CA--C 1.561 1.858 0 C-N-CA 123.017 2.478 . . . . 71.040000000000006 113.815 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 79.1 p -80.59 161.44 24.73 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.589 0.756 . . . . 75.239999999999995 111.732 -177.745 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 99.0 p -67.05 -23.77 65.91 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.04 0.536 . . . . 72.109999999999999 111.587 174.745 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -69.8 -32.04 70.28 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.531 0.732 . . . . 65.129999999999995 111.492 173.725 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 86.3 m -78.04 -37.17 47.45 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.048 0.539 . . . . 72.310000000000002 109.636 178.228 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -64.7 -32.08 73.59 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.405 0.682 . . . . 73.420000000000002 111.39 172.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.62 -39.51 88.36 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 123.415 0.686 . . . . 74.329999999999998 111.26 173.527 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -63.05 -49.16 75.67 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.264 0.625 . . . . 72.200000000000003 110.797 172.087 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 77.9 mt -63.62 -23.76 67.52 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 124.79 1.236 . . . . 65.109999999999999 113.032 -179.652 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.75 -55.03 34.52 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 123.088 0.555 . . . . 45.5 110.998 170.295 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.67 -27.83 62.34 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.586 0.754 . . . . 64.040000000000006 112.351 179.223 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -75.91 -39.02 57.1 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.184 0.993 . . . . 71.319999999999993 111.325 -177.109 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.463 HD21 ' HB ' ' A' ' 24' ' ' VAL . 91.0 mt -106.26 12.75 29.66 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.759 0.824 . . . . 72.540000000000006 112.687 -177.312 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.0 p30 51.37 23.95 1.95 Allowed 'General case' 0 N--CA 1.501 2.117 0 C-N-CA 125.548 1.539 . . . . 75.409999999999997 114.09 -174.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -106.82 -175.01 2.67 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 123.615 0.766 . . . . 71.420000000000002 111.565 -178.221 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 47.5 m-80 -96.55 143.84 26.82 Favored Pre-proline 0 N--CA 1.492 1.628 0 C-N-CA 123.084 0.554 . . . . 74.140000000000001 110.431 173.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -66.24 -26.74 48.96 Favored 'Trans proline' 0 C--N 1.379 2.137 0 C-N-CA 122.653 2.235 . . . . 42.240000000000002 113.512 -171.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -71.76 -38.77 70.33 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.46 0.704 . . . . 74.319999999999993 111.32 178.264 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 12.0 mp0 -70.75 -35.14 72.5 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.174 0.59 . . . . 73.340000000000003 110.849 176.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 86.1 t -62.4 -47.36 93.37 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 C-N-CA 123.375 0.67 . . . . 61.509999999999998 111.26 174.475 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 90.9 p -65.67 -41.7 92.18 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.35 0.66 . . . . 74.109999999999999 112.161 -177.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -64.92 -48.97 72.25 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 122.675 0.39 . . . . 72.420000000000002 111.63 177.018 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.46 ' NH1' ' HB3' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -70.08 -23.98 63.16 Favored 'General case' 0 CA--C 1.561 1.368 0 C-N-CA 123.313 0.645 . . . . 72.530000000000001 111.215 -177.079 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.484 ' HA ' HD12 ' A' ' 60' ' ' LEU . 23.9 t80 -61.13 -49.29 77.86 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 123.979 0.912 . . . . 75.099999999999994 111.556 170.71 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -73.88 -24.42 59.73 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 115.465 -0.789 . . . . 71.099999999999994 111.143 -178.801 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -72.35 -32.81 66.79 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.58 0.752 . . . . 75.239999999999995 111.102 171.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.629 HD21 ' HB2' ' A' ' 22' ' ' ASP . 15.3 mt -58.58 -55.54 33.79 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.415 0.686 . . . . 72.299999999999997 111.142 173.218 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 27.9 mmt . . . . . 0 N--CA 1.484 1.259 0 C-N-CA 123.015 0.526 . . . . 72.030000000000001 112.018 178.844 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 29.4 m . . . . . 0 N--CA 1.489 1.516 0 CA-C-O 120.314 0.102 . . . . 63.130000000000003 110.904 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 48.2 m80 -68.32 151.14 47.34 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.039 0.536 . . . . 73.140000000000001 112.181 -179.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 60.8 mtt -69.7 104.55 2.44 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 115.585 -0.734 . . . . 63.240000000000002 110.295 177.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 40.7 mtmt 68.77 171.71 0.29 Allowed 'General case' 0 N--CA 1.496 1.866 0 C-N-CA 125.114 1.366 . . . . 62.439999999999998 112.614 -176.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -155.88 147.12 22.52 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.623 0.769 . . . . 73.329999999999998 110.762 175.293 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 35.5 m -112.13 4.75 8.33 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.464 0 C-N-CA 123.444 0.697 . . . . 61.119999999999997 111.765 177.431 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.5 mp -88.79 102.91 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.096 0 C-N-CA 123.345 0.658 . . . . 73.120000000000005 109.259 -179.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 50.9 tttm -156.91 113.62 3.04 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 122.732 0.413 . . . . 71.150000000000006 111.439 -176.021 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.571 ' H ' HD13 ' A' ' 63' ' ' LEU . 59.6 mttp -100.02 167.93 10.17 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.549 0.739 . . . . 72.099999999999994 110.955 168.566 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.5 mtpm? -84.62 124.72 31.76 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 123.316 0.646 . . . . 73.109999999999999 110.92 178.367 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -98.14 16.59 59.88 Favored Glycine 0 N--CA 1.481 1.638 0 C-N-CA 122.574 0.13 . . . . 64.049999999999997 112.778 177.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.547 ' HB3' HH21 ' A' ' 56' ' ' ARG . 0.6 OUTLIER -151.26 154.72 37.33 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.872 0.869 . . . . 53.32 111.681 -173.564 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.473 HG22 HG23 ' A' ' 14' ' ' ILE . 3.3 mp -105.96 -50.75 8.25 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.252 0 C-N-CA 124.078 0.951 . . . . 73.129999999999995 110.876 -175.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.473 HG23 HG22 ' A' ' 13' ' ' ILE . 30.3 pt -122.26 5.7 5.74 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.162 0 C-N-CA 123.698 0.799 . . . . 72.120000000000005 112.877 -175.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 54.9 mt -100.24 139.0 22.75 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.577 0 C-N-CA 123.189 0.595 . . . . 71.299999999999997 110.659 -176.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 59.8 tp -78.32 103.22 8.12 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.35 0.66 . . . . 73.439999999999998 111.766 -176.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 90.9 m95 -131.87 128.9 39.6 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.566 0.746 . . . . 74.310000000000002 110.389 174.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 44.8 p -126.16 169.44 12.83 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 123.117 0.567 . . . . 65.019999999999996 111.201 179.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -51.9 -33.11 35.45 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 124.831 1.252 . . . . 74.319999999999993 114.063 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.405 ' O ' HG23 ' A' ' 24' ' ' VAL . 14.6 t-20 -73.52 -34.73 65.38 Favored 'General case' 0 CA--C 1.558 1.267 0 C-N-CA 123.094 0.558 . . . . 71.439999999999998 111.244 -176.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -69.71 -52.38 26.07 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.307 0.643 . . . . 73.010000000000005 112.013 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.9 m-20 -58.83 -31.63 68.65 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.852 0.861 . . . . 64.530000000000001 112.549 -178.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 74.4 ttt180 -62.59 -46.2 89.41 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 122.29 0.236 . . . . 71.420000000000002 111.068 174.145 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 20' ' ' ASN . 36.8 t -63.37 -39.15 84.21 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 C-N-CA 123.253 0.621 . . . . 74.400000000000006 111.092 -179.087 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.417 ' HA ' HD13 ' A' ' 42' ' ' LEU . 87.0 mt -54.81 -57.79 5.79 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.238 0 C-N-CA 123.225 0.61 . . . . 73.129999999999995 110.95 175.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 94.2 mt -63.05 -34.07 76.79 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.399 0.68 . . . . 55.210000000000001 112.142 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 31.7 tp -65.01 -53.39 46.9 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.428 0.691 . . . . 75.430000000000007 111.626 -177.259 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 48.1 mm-40 -75.76 -24.63 56.08 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 122.846 0.458 . . . . 74.120000000000005 112.2 179.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 41.5 t -68.94 -38.5 79.51 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 122.677 0.391 . . . . 64.409999999999997 111.364 177.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -80.75 -35.18 33.67 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.232 0.613 . . . . 73.349999999999994 111.203 177.184 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -64.28 -47.15 80.64 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 123.531 0.732 . . . . 71.409999999999997 111.852 177.313 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 36.8 mtt180 -104.6 -68.21 0.86 Allowed 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.649 0.78 . . . . 72.010000000000005 110.719 -173.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 145.81 135.51 2.81 Favored Glycine 0 CA--C 1.534 1.227 0 CA-C-O 118.885 -0.953 . . . . 74.329999999999998 110.912 -172.024 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -66.76 87.75 0.29 Allowed 'Trans proline' 0 CA--C 1.561 1.872 0 C-N-CA 122.716 2.278 . . . . 72.230000000000004 113.342 -178.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 98.7 p -126.55 163.45 23.38 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.128 0.971 . . . . 71.519999999999996 110.149 178.312 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 68.8 p -55.15 -39.82 69.9 Favored 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 123.953 0.901 . . . . 71.230000000000004 113.027 -179.39 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 63.7 pttt -73.76 -25.98 60.42 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.496 0.718 . . . . 73.519999999999996 112.335 179.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 86.4 m -76.1 -39.56 54.98 Favored 'General case' 0 N--CA 1.484 1.24 0 N-CA-C 108.87 -0.789 . . . . 52.020000000000003 108.87 175.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -67.16 -28.83 68.45 Favored 'General case' 0 CA--C 1.55 0.959 0 CA-C-N 115.322 -0.854 . . . . 72.25 111.254 173.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.09 -35.95 66.71 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.749 0.82 . . . . 65.319999999999993 111.863 175.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -62.71 -50.37 71.39 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.184 0.594 . . . . 72.310000000000002 110.406 171.724 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.439 ' HB2' HG11 ' A' ' 53' ' ' VAL . 76.3 mt -66.21 -25.64 67.02 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.555 1.142 . . . . 70.040000000000006 112.192 177.229 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.39 -58.48 5.2 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.315 0.646 . . . . 64.030000000000001 111.117 175.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -59.84 -36.15 76.23 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 123.5 0.72 . . . . 51.409999999999997 111.945 178.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.25 -49.75 70.67 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 124.175 0.99 . . . . 74.099999999999994 111.81 176.217 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 52.3 mt -99.5 14.6 29.32 Favored 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 113.196 0.813 . . . . 65.310000000000002 113.196 -170.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 68.25 13.96 9.14 Favored 'General case' 0 N--CA 1.508 2.434 0 C-N-CA 125.071 1.349 . . . . 74.010000000000005 113.211 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 71.8 mmtt -103.48 -176.72 3.16 Favored 'General case' 0 N--CA 1.483 1.182 0 CA-C-O 121.768 0.794 . . . . 52.420000000000002 112.843 -173.549 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -102.76 153.91 37.88 Favored Pre-proline 0 CA--C 1.559 1.296 0 CA-C-N 115.003 -0.999 . . . . 52.420000000000002 109.421 166.484 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 92.0 Cg_exo -47.11 -35.12 18.7 Favored 'Trans proline' 0 C--N 1.388 2.645 0 C-N-CA 123.623 2.882 . . . . 73.430000000000007 114.631 177.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.41 ' O ' ' HG3' ' A' ' 55' ' ' GLU . 78.8 m-20 -59.63 -50.55 73.42 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.613 0.765 . . . . 75.5 111.585 176.84 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 83.1 mm-40 -55.83 -46.43 78.13 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 123.56 0.744 . . . . 74.219999999999999 112.111 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.439 HG11 ' HB2' ' A' ' 42' ' ' LEU . 76.8 t -64.74 -45.78 94.14 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 CA-C-N 115.163 -0.926 . . . . 60.25 111.631 -178.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.3 t -59.47 -44.13 93.08 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.303 0.641 . . . . 62.32 111.941 179.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.418 ' O ' ' HG2' ' A' ' 59' ' ' GLN . 60.0 mt-10 -57.78 -50.82 71.97 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.127 0.571 . . . . 73.430000000000007 111.435 177.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.547 HH21 ' HB3' ' A' ' 12' ' ' GLU . 40.3 mmt-85 -68.78 -35.2 76.75 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 122.677 0.391 . . . . 74.230000000000004 111.908 -176.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -52.77 -52.77 55.25 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 123.422 0.689 . . . . 54.240000000000002 110.964 170.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -69.61 -25.14 63.81 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 115.337 -0.847 . . . . 44.420000000000002 112.133 -176.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.453 ' O ' ' HG ' ' A' ' 63' ' ' LEU . 30.9 mm-40 -68.56 -54.42 16.74 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 109.373 -0.602 . . . . 61.100000000000001 109.373 172.406 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 21.0 mt -47.61 -48.02 28.53 Favored 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 125.02 1.328 . . . . 63.409999999999997 112.607 179.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 23.7 mmt -58.62 -51.31 70.47 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 123.297 0.639 . . . . 72.430000000000007 111.667 178.064 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 58.0 mtpt -65.04 -27.1 68.57 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.848 0.859 . . . . 74.540000000000006 112.724 -179.186 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.571 HD13 ' H ' ' A' ' 9' ' ' LYS . 96.0 mt -70.78 -37.42 73.33 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.296 0.638 . . . . 72.120000000000005 111.636 175.256 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -74.24 -30.8 62.32 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 122.584 0.354 . . . . 74.049999999999997 111.56 177.189 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -78.5 -58.83 3.05 Favored 'General case' 0 CA--C 1.558 1.264 0 C-N-CA 123.192 0.597 . . . . 75.319999999999993 112.41 179.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 3.9 mppt? -110.93 -58.55 2.08 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.597 0.759 . . . . 74.0 112.127 -175.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 33.9 t 67.53 -66.98 0.19 Allowed 'General case' 0 N--CA 1.501 2.121 0 C-N-CA 125.168 1.387 . . . . 64.510000000000005 112.391 -172.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp 64.83 -169.98 0.2 Allowed 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 125.136 1.374 . . . . 75.230000000000004 112.794 177.317 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 75.8 m -142.15 103.3 4.27 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.181 0.593 . . . . 73.340000000000003 110.56 -179.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 25.9 ttm180 . . . . . 0 CA--C 1.561 1.366 0 C-N-CA 123.421 0.688 . . . . 70.319999999999993 110.06 178.799 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 23.1 t . . . . . 0 N--CA 1.494 1.726 0 N-CA-C 110.647 -0.131 . . . . 73.209999999999994 110.647 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 59.7 m-70 -74.11 85.73 1.85 Allowed 'General case' 0 CA--C 1.555 1.165 0 C-N-CA 123.388 0.675 . . . . 71.219999999999999 110.663 -179.31 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 21.3 ttt -110.97 145.09 39.02 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.415 0.686 . . . . 74.530000000000001 110.358 -175.048 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 66.5 mmtt 66.18 93.34 0.07 Allowed 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 124.581 1.152 . . . . 74.120000000000005 111.684 -171.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 41.7 m-20 -95.97 83.38 3.65 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 108.825 -0.805 . . . . 75.329999999999998 108.825 173.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 46.3 t -70.01 101.11 0.72 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.041 0 C-N-CA 123.163 0.585 . . . . 64.239999999999995 111.149 -171.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 35.3 pt -71.8 148.21 10.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 CA-C-N 115.828 -0.624 . . . . 74.310000000000002 111.303 175.306 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.6 pttt -159.93 176.44 11.88 Favored 'General case' 0 N--CA 1.48 1.068 0 CA-C-N 115.784 -0.644 . . . . 75.319999999999993 111.936 -171.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 21.7 pttp -64.19 152.1 41.68 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.223 1.009 . . . . 71.040000000000006 113.163 -177.362 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 10.6 tmtt? -128.27 78.54 1.84 Allowed 'General case' 0 CA--C 1.554 1.126 0 N-CA-C 108.27 -1.011 . . . . 74.129999999999995 108.27 172.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -120.91 24.77 7.37 Favored Glycine 0 N--CA 1.477 1.413 0 CA-C-N 115.602 -0.726 . . . . 65.140000000000001 112.001 174.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -125.86 121.83 34.35 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.197 0.999 . . . . 75.150000000000006 110.021 -174.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.656 HG22 ' H ' ' A' ' 15' ' ' ILE . 59.0 mt 69.61 137.95 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 C-N-CA 125.526 1.53 . . . . 74.420000000000002 112.376 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 32.2 pt -68.24 -22.83 27.88 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 C-N-CA 123.79 0.836 . . . . 52.149999999999999 113.159 -178.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.656 ' H ' HG22 ' A' ' 13' ' ' ILE . 16.4 mt -84.84 130.17 36.49 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.194 0 C-N-CA 124.032 0.933 . . . . 74.150000000000006 110.223 -178.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -79.56 132.25 36.24 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 123.255 0.622 . . . . 75.120000000000005 109.924 175.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -137.9 130.39 29.42 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 123.631 0.772 . . . . 74.340000000000003 110.195 176.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 30.7 p -135.38 168.57 18.97 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 124.137 0.975 . . . . 60.109999999999999 110.448 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 14.5 ptm180 -57.9 -28.33 64.12 Favored 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 113.976 1.102 . . . . 73.510000000000005 113.976 -171.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -68.82 -34.53 75.66 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.263 0.625 . . . . 65.239999999999995 111.463 178.002 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.418 ' HA ' HD22 ' A' ' 46' ' ' LEU . 47.8 m-20 -66.48 -57.7 6.79 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.003 0.521 . . . . 74.450000000000003 110.718 175.218 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -54.26 -39.01 66.46 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.506 1.122 . . . . 73.109999999999999 112.781 -179.471 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 61.3 ttt-85 -60.1 -50.33 74.13 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.191 0.597 . . . . 75.340000000000003 111.938 178.392 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 38.4 t -75.0 -31.71 25.63 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 122.708 0.403 . . . . 63.399999999999999 111.048 -174.154 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 75.1 mt -60.84 -48.57 88.32 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 C-N-CA 122.146 0.178 . . . . 65.5 110.621 172.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 96.3 mt -66.62 -34.8 78.67 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 123.186 0.594 . . . . 72.420000000000002 112.317 177.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 64.2 tp -61.87 -48.08 82.13 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.66 0.784 . . . . 74.200000000000003 111.298 177.657 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.55 ' HB3' HG23 ' A' ' 38' ' ' THR . 26.4 mm-40 -72.56 -32.42 66.04 Favored 'General case' 0 CA--C 1.551 0.988 0 CA-C-N 114.767 -1.106 . . . . 73.25 112.088 176.284 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.667 ' HG ' ' HE1' ' A' ' 57' ' ' PHE . 13.9 t -65.45 -35.46 80.98 Favored 'General case' 0 N--CA 1.491 1.598 0 C-N-CA 123.714 0.805 . . . . 73.319999999999993 112.212 179.478 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.8 mt-30 -90.39 -3.95 57.37 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.057 0.543 . . . . 55.329999999999998 111.963 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 27.0 tptp -113.15 -73.3 0.67 Allowed 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 123.123 0.569 . . . . 71.230000000000004 110.74 178.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 61.5 mtt180 -81.21 -10.61 59.58 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 123.257 0.623 . . . . 64.409999999999997 112.435 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 82.21 -165.22 44.8 Favored Glycine 0 CA--C 1.538 1.529 0 N-CA-C 114.611 0.604 . . . . 52.210000000000001 114.611 173.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -82.39 35.78 0.59 Allowed 'Trans proline' 0 C--N 1.374 1.906 0 C-N-CA 123.54 2.827 . . . . 60.229999999999997 113.557 176.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 65.4 m -76.34 152.66 36.29 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.166 0.586 . . . . 65.150000000000006 112.182 -177.651 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 87.5 p -63.7 -30.09 71.23 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 123.252 0.621 . . . . 73.400000000000006 110.462 168.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -55.37 -40.04 70.83 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 124.417 1.087 . . . . 63.200000000000003 110.977 170.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.55 HG23 ' HB3' ' A' ' 28' ' ' GLU . 32.2 m -75.76 -47.32 26.41 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-N 114.827 -1.079 . . . . 51.520000000000003 109.414 -174.248 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 21.1 m-85 -63.71 -30.43 71.53 Favored 'General case' 0 CA--C 1.551 0.997 0 CA-C-N 114.802 -1.09 . . . . 74.519999999999996 112.042 178.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.79 -42.57 77.16 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.421 0.688 . . . . 71.239999999999995 111.341 175.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 73.7 t80 -61.28 -55.75 28.38 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 122.791 0.436 . . . . 62.43 110.522 174.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.402 ' HB2' HG11 ' A' ' 53' ' ' VAL . 72.8 mt -61.47 -25.65 67.38 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 124.486 1.115 . . . . 60.43 113.107 -178.173 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.47 -56.13 18.6 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-O 121.153 0.502 . . . . 55.020000000000003 111.231 173.085 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -71.66 -30.63 65.94 Favored 'General case' 0 N--CA 1.482 1.174 0 CA-C-N 116.014 -0.539 . . . . 62.409999999999997 112.213 -178.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 8.5 tmtm? -73.91 -53.78 9.4 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.988 0.915 . . . . 75.120000000000005 110.659 -176.36 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.418 HD22 ' HA ' ' A' ' 21' ' ' ASP . 88.3 mt -86.73 3.06 46.48 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.262 0.625 . . . . 71.530000000000001 112.67 -175.667 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.0 t70 60.5 34.21 20.44 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-O 122.372 1.082 . . . . 61.340000000000003 110.666 -175.336 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 47.5 mmtm -107.17 -177.86 3.48 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-N 115.0 -1.0 . . . . 64.120000000000005 111.291 179.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.492 HD22 ' N ' ' A' ' 49' ' ' ASN . 0.7 OUTLIER -105.37 148.28 36.03 Favored Pre-proline 0 CA--C 1.554 1.131 0 N-CA-C 108.84 -0.8 . . . . 72.319999999999993 108.84 172.445 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_exo -53.4 -34.95 73.53 Favored 'Trans proline' 0 C--N 1.384 2.441 0 C-N-CA 122.746 2.297 . . . . 74.430000000000007 114.329 178.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 23.8 m120 -68.06 -44.72 75.69 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.654 0.382 . . . . 72.219999999999999 111.267 174.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.454 ' HG3' ' HB2' ' A' ' 49' ' ' ASN . 96.5 mt-30 -57.75 -45.4 85.93 Favored 'General case' 0 N--CA 1.494 1.73 0 C-N-CA 123.037 0.535 . . . . 54.219999999999999 111.393 176.25 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.402 HG11 ' HB2' ' A' ' 42' ' ' LEU . 87.9 t -63.83 -50.88 75.7 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.896 0 C-N-CA 123.717 0.807 . . . . 71.120000000000005 111.628 -179.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.447 ' O ' ' HG3' ' A' ' 58' ' ' GLN . 90.2 p -60.78 -43.41 98.13 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.185 0.594 . . . . 54.130000000000003 112.21 -176.313 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.437 ' O ' ' HG2' ' A' ' 59' ' ' GLN . 44.0 mt-10 -67.05 -43.66 82.16 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.148 0.579 . . . . 71.439999999999998 111.871 178.427 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 22.1 tpt180 -62.9 -39.95 96.1 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 123.137 0.575 . . . . 74.230000000000004 111.396 177.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.667 ' HE1' ' HG ' ' A' ' 29' ' ' CYS . 3.5 t80 -52.37 -48.3 65.67 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.547 1.139 . . . . 74.420000000000002 111.045 172.365 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.447 ' HG3' ' O ' ' A' ' 54' ' ' SER . 49.6 mt-30 -66.74 -34.51 78.0 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 115.851 -0.613 . . . . 74.120000000000005 111.532 -179.291 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.437 ' HG2' ' O ' ' A' ' 55' ' ' GLU . 11.7 mm-40 -69.96 -33.36 71.99 Favored 'General case' 0 N--CA 1.486 1.345 0 CA-C-O 120.893 0.378 . . . . 72.140000000000001 110.579 177.905 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.458 HD23 HD12 ' A' ' 63' ' ' LEU . 32.8 mt -62.38 -41.91 99.0 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.059 0.944 . . . . 74.209999999999994 111.331 170.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 34.5 mmt -60.53 -40.24 90.77 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 123.388 0.675 . . . . 74.400000000000006 111.057 175.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -65.76 -27.94 68.67 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.744 0.818 . . . . 73.549999999999997 112.556 176.029 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.458 HD12 HD23 ' A' ' 60' ' ' LEU . 97.0 mt -68.37 -36.63 79.48 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 122.793 0.437 . . . . 75.530000000000001 111.789 176.044 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -64.67 -37.78 88.75 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 122.998 0.519 . . . . 75.010000000000005 111.46 175.383 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 53.5 mt-10 -70.03 -48.67 57.01 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.019 0.528 . . . . 71.409999999999997 110.77 175.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 53.2 tttm 71.7 -53.53 0.68 Allowed 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 126.651 1.981 . . . . 51.32 113.246 179.071 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 44.3 t -52.45 -36.32 54.36 Favored 'General case' 0 N--CA 1.499 1.98 0 C-N-CA 124.019 0.928 . . . . 53.509999999999998 112.88 176.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 56.8 tptt -68.13 -56.59 8.25 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 123.176 0.59 . . . . 72.129999999999995 110.961 175.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 42.0 t 53.91 75.37 0.28 Allowed 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 124.383 1.073 . . . . 60.009999999999998 111.797 -178.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 48.0 ttp180 . . . . . 0 CA--C 1.572 1.805 0 C-N-CA 125.042 1.337 . . . . 63.149999999999999 111.68 -175.358 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 40.1 t . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.898 0.38 . . . . 64.530000000000001 110.862 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 86.2 m-70 -126.82 136.34 52.24 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.722 0.809 . . . . 70.420000000000002 110.216 178.281 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 60.1 mtt -90.66 -178.55 5.31 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.065 0.546 . . . . 74.049999999999997 110.011 168.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.433 ' NZ ' ' HB3' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -79.68 87.11 5.22 Favored 'General case' 0 CA--C 1.555 1.158 0 N-CA-C 107.872 -1.158 . . . . 72.120000000000005 107.872 172.632 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 2.3 p-10 -137.95 99.36 3.88 Favored 'General case' 0 CA--C 1.55 0.961 0 C-N-CA 123.767 0.827 . . . . 75.230000000000004 110.074 178.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 18.5 m -93.83 106.4 18.0 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.079 0 CA-C-O 121.428 0.632 . . . . 75.140000000000001 110.427 176.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.669 ' HB ' ' HA ' ' A' ' 64' ' ' PHE . 2.9 mp -89.79 3.01 6.55 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.65 0 CA-C-O 121.64 0.733 . . . . 61.219999999999999 109.458 175.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -65.88 91.64 0.15 Allowed 'General case' 0 CA--C 1.558 1.28 0 C-N-CA 124.138 0.975 . . . . 75.230000000000004 110.427 172.159 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 4.6 ttmp? -127.93 -69.03 0.75 Allowed 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.635 0.774 . . . . 61.240000000000002 110.838 -178.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -88.59 96.61 10.71 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.364 0.666 . . . . 74.129999999999995 110.899 -173.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 171.0 106.87 0.19 Allowed Glycine 0 CA--C 1.53 0.982 0 CA-C-N 115.784 -0.643 . . . . 72.409999999999997 112.214 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -78.95 143.71 35.52 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.356 0.662 . . . . 73.439999999999998 111.675 -178.595 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.515 HD12 ' HB2' ' A' ' 17' ' ' TRP . 13.6 pt -132.18 125.6 54.63 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.161 0 C-N-CA 124.262 1.025 . . . . 65.329999999999998 110.68 179.584 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 41.8 mm -81.21 -41.67 19.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.141 0 C-N-CA 123.386 0.674 . . . . 64.219999999999999 110.399 178.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 33.8 mt -73.02 144.62 12.66 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 CA-C-N 114.765 -1.107 . . . . 61.240000000000002 110.152 178.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 7.0 mp -66.81 89.21 0.15 Allowed 'General case' 0 CA--C 1.559 1.295 0 C-N-CA 123.614 0.766 . . . . 75.540000000000006 110.967 -179.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . 0.515 ' HB2' HD12 ' A' ' 13' ' ' ILE . 79.3 m95 -118.38 109.07 15.83 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.98 0.912 . . . . 74.409999999999997 109.851 177.201 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 19.4 p -108.48 168.29 9.43 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 122.245 -0.284 . . . . 74.409999999999997 110.684 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 24.1 ptt-85 -53.85 -21.78 8.38 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 124.401 1.081 . . . . 65.329999999999998 112.912 176.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.402 ' O ' HG23 ' A' ' 24' ' ' VAL . 22.8 m-80 -74.14 -49.6 23.04 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.359 0.664 . . . . 74.200000000000003 110.329 175.289 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -60.29 -58.95 6.34 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.895 0.878 . . . . 71.019999999999996 111.768 -178.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.612 ' HB2' HD21 ' A' ' 60' ' ' LEU . 2.1 p30 -66.2 -31.67 72.63 Favored 'General case' 0 CA--C 1.558 1.282 0 N-CA-C 113.268 0.84 . . . . 74.420000000000002 113.268 -172.492 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 34.9 ttt180 -60.23 -44.06 95.52 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 123.487 0.715 . . . . 73.310000000000002 111.64 173.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.402 HG23 ' O ' ' A' ' 20' ' ' ASN . 80.3 t -66.52 -37.61 79.96 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 C-N-CA 123.225 0.61 . . . . 44.439999999999998 111.201 177.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 78.1 mt -58.13 -56.2 17.45 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 C-N-CA 122.749 0.42 . . . . 71.25 111.151 176.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.584 ' HG ' HD13 ' A' ' 60' ' ' LEU . 78.5 mt -57.99 -37.32 74.02 Favored 'General case' 0 N--CA 1.484 1.231 0 N-CA-C 112.322 0.49 . . . . 55.310000000000002 112.322 179.148 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 46.4 tp -63.65 -51.56 64.63 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.591 0.756 . . . . 74.340000000000003 112.447 -178.703 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -77.97 -22.24 49.72 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 112.679 0.622 . . . . 74.530000000000001 112.679 179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 80.3 m -75.35 -41.66 56.05 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 112.215 0.45 . . . . 74.319999999999993 112.215 177.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -70.14 -29.25 66.13 Favored 'General case' 0 N--CA 1.491 1.625 0 C-N-CA 122.711 0.404 . . . . 60.420000000000002 111.204 175.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -73.98 -66.9 0.66 Allowed 'General case' 0 CA--C 1.555 1.15 0 C-N-CA 124.045 0.938 . . . . 63.210000000000001 111.212 177.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 60.7 mtt-85 -80.41 -56.85 3.9 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.193 0.997 . . . . 73.239999999999995 111.328 -171.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 129.71 154.78 8.23 Favored Glycine 0 CA--C 1.538 1.523 0 CA-C-O 119.356 -0.691 . . . . 72.319999999999993 112.499 -177.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_exo -65.46 94.3 0.25 Allowed 'Trans proline' 0 C--N 1.377 2.042 0 C-N-CA 123.27 2.647 . . . . 74.430000000000007 112.684 176.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 67.3 m -142.24 155.64 45.26 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 124.07 0.948 . . . . 74.129999999999995 110.587 -178.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 91.2 p -59.92 -40.31 88.43 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 123.319 0.647 . . . . 63.420000000000002 112.411 -176.909 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 38.6 mtmm -68.37 -24.41 64.79 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.041 0.537 . . . . 73.140000000000001 112.337 176.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 68.5 m -78.19 -43.05 29.59 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 109.225 -0.657 . . . . 64.319999999999993 109.225 -179.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 34.5 m-85 -72.07 -29.19 63.89 Favored 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 115.267 -0.879 . . . . 72.430000000000007 111.563 176.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -75.15 -34.72 61.65 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.518 0.727 . . . . 74.019999999999996 111.329 174.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 86.2 t80 -63.91 -48.53 76.25 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 122.995 0.518 . . . . 71.230000000000004 110.392 172.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.445 ' HB2' HG11 ' A' ' 53' ' ' VAL . 81.7 mt -66.36 -27.28 67.76 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.26 1.024 . . . . 70.519999999999996 112.109 176.255 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -66.83 -42.32 86.02 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.074 0.55 . . . . 54.229999999999997 111.207 172.36 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.42 -34.88 68.17 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.157 0.583 . . . . 61.310000000000002 111.478 175.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 58.8 tptt -67.21 -40.25 86.41 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.843 1.257 . . . . 71.200000000000003 111.358 -179.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 46.8 mt -109.26 12.23 24.96 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.807 0.843 . . . . 73.120000000000005 112.263 -175.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 2.7 p30 49.49 22.77 0.78 Allowed 'General case' 0 N--CA 1.51 2.527 0 C-N-CA 126.327 1.851 . . . . 74.340000000000003 114.75 -175.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 44.9 mmtm -99.67 -172.17 2.2 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.838 0.855 . . . . 63.310000000000002 111.319 179.388 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 32.6 m-80 -98.71 145.57 30.15 Favored Pre-proline 0 N--CA 1.489 1.512 0 C-N-CA 123.495 0.718 . . . . 73.25 110.52 176.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_exo -57.76 -32.73 95.54 Favored 'Trans proline' 0 C--N 1.387 2.558 0 C-N-CA 123.293 2.662 . . . . 54.549999999999997 113.839 -178.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -61.46 -48.93 78.89 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.998 0.919 . . . . 65.5 111.25 174.357 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -63.3 -41.35 98.95 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.822 0.849 . . . . 75.420000000000002 111.396 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.445 HG11 ' HB2' ' A' ' 42' ' ' LEU . 93.9 t -65.49 -42.99 94.51 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.289 0 C-N-CA 123.878 0.871 . . . . 35.109999999999999 111.441 177.787 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 37.8 t -64.2 -44.14 92.88 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.69 0.796 . . . . 51.329999999999998 111.904 -178.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.409 ' O ' ' HG3' ' A' ' 59' ' ' GLN . 47.4 mt-10 -65.97 -42.7 89.58 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 123.229 0.612 . . . . 62.240000000000002 111.327 174.431 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.433 ' HE ' ' HB3' ' A' ' 22' ' ' ASP . 32.2 tpt180 -60.86 -41.76 96.53 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.284 0.633 . . . . 72.030000000000001 111.414 -179.794 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 16.1 t80 -53.08 -48.27 67.88 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 124.247 1.019 . . . . 64.349999999999994 111.385 173.062 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -75.17 -24.67 57.92 Favored 'General case' 0 CA--C 1.555 1.145 0 CA-C-N 115.168 -0.923 . . . . 72.310000000000002 112.315 -178.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.409 ' HG3' ' O ' ' A' ' 55' ' ' GLU . 98.0 mt-30 -68.36 -45.03 73.9 Favored 'General case' 0 N--CA 1.487 1.417 0 N-CA-C 109.448 -0.575 . . . . 70.430000000000007 109.448 171.579 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.612 HD21 ' HB2' ' A' ' 22' ' ' ASP . 31.6 mt -56.01 -56.37 21.58 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.381 1.072 . . . . 72.439999999999998 111.75 175.464 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 17.2 mmt -65.62 -29.25 69.81 Favored 'General case' 0 N--CA 1.481 1.095 0 N-CA-C 112.696 0.628 . . . . 54.140000000000001 112.696 -178.102 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -76.58 -43.6 38.09 Favored 'General case' 0 N--CA 1.484 1.232 0 N-CA-C 112.358 0.503 . . . . 64.209999999999994 112.358 177.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 84.3 mt -75.86 -42.62 48.85 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 123.192 0.597 . . . . 65.25 111.67 -178.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.669 ' HA ' ' HB ' ' A' ' 7' ' ' ILE . 18.6 m-85 -64.44 -22.28 66.91 Favored 'General case' 0 N--CA 1.493 1.697 0 C-N-CA 123.462 0.705 . . . . 52.140000000000001 111.722 173.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 -73.6 -62.64 1.42 Allowed 'General case' 0 CA--C 1.552 1.055 0 N-CA-C 108.832 -0.803 . . . . 74.109999999999999 108.832 169.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 94.9 mttt -161.15 121.87 2.79 Favored 'General case' 0 N--CA 1.493 1.712 0 C-N-CA 125.837 1.655 . . . . 70.129999999999995 108.687 177.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 65.0 m -62.39 116.49 5.11 Favored 'General case' 0 N--CA 1.49 1.555 0 N-CA-C 112.626 0.602 . . . . 72.129999999999995 112.626 179.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 53.1 tttp -77.8 118.93 20.62 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 123.597 0.759 . . . . 74.420000000000002 109.424 173.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 46.7 t -78.98 66.2 4.36 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.544 0.738 . . . . 74.319999999999993 112.425 -173.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 6.5 tpm_? . . . . . 0 C--O 1.256 1.397 0 C-N-CA 124.511 1.124 . . . . 74.219999999999999 110.763 175.248 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 41.1 t . . . . . 0 N--CA 1.497 1.892 0 CA-C-O 120.586 0.231 . . . . 64.049999999999997 111.387 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 50.1 m80 -124.41 98.09 5.59 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.577 0.751 . . . . 72.030000000000001 109.865 177.008 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 84.2 mtp -122.73 108.12 12.7 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.359 0.664 . . . . 44.409999999999997 111.595 -175.1 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 54.9 pttt -106.17 111.16 23.66 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.548 0.739 . . . . 75.540000000000006 109.349 169.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -65.51 120.13 12.31 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 122.789 0.436 . . . . 63.43 111.478 -177.029 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.4 p -63.85 97.22 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.562 1.421 0 C-N-CA 123.576 0.75 . . . . 32.030000000000001 111.057 179.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 31.2 pt -67.81 92.26 0.2 Allowed 'Isoleucine or valine' 0 CA--C 1.559 1.31 0 CA-C-O 122.353 1.073 . . . . 71.120000000000005 111.655 -177.698 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -78.24 113.89 16.62 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 115.201 -0.909 . . . . 73.329999999999998 110.878 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -84.8 151.89 24.03 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 123.106 0.563 . . . . 73.319999999999993 110.113 171.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 34.1 ttpt 64.99 102.2 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 124.702 1.201 . . . . 55.329999999999998 112.098 -176.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -85.2 126.57 7.77 Favored Glycine 0 C--N 1.342 0.915 0 N-CA-C 110.333 -1.107 . . . . 50.43 110.333 166.605 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -61.62 143.51 55.96 Favored 'General case' 0 CA--C 1.562 1.43 0 CA-C-N 117.528 0.664 . . . . 72.519999999999996 112.701 -175.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 59.5 mt -79.89 152.57 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 C-N-CA 123.946 0.898 . . . . 73.219999999999999 109.772 178.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 71.8 mt 75.97 -61.59 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 C-N-CA 125.192 1.397 . . . . 75.109999999999999 110.532 -171.055 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.45 HD12 ' HE1' ' A' ' 17' ' ' TRP . 10.8 pt -114.23 114.32 46.34 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 C-N-CA 124.521 1.129 . . . . 71.530000000000001 111.191 -178.422 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 37.8 tp -81.67 78.18 8.43 Favored 'General case' 0 CA--C 1.552 1.02 0 CA-C-O 121.559 0.695 . . . . 71.340000000000003 111.094 -178.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . 0.45 ' HE1' HD12 ' A' ' 15' ' ' ILE . 90.8 m95 -65.87 119.99 12.27 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-N 115.326 -0.852 . . . . 75.349999999999994 110.545 165.219 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 44.5 p -116.89 169.82 9.09 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 123.092 0.557 . . . . 64.209999999999994 110.222 176.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 16.7 ptt180 -57.81 -20.84 38.58 Favored 'General case' 0 N--CA 1.488 1.466 0 N-CA-C 112.32 0.489 . . . . 72.239999999999995 112.32 177.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.434 ' O ' HG23 ' A' ' 24' ' ' VAL . 27.2 m-80 -70.19 -50.63 38.22 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.227 0.611 . . . . 73.209999999999994 110.391 175.453 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.459 ' HA ' HD22 ' A' ' 46' ' ' LEU . 16.5 m-20 -65.12 -54.8 24.36 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.239 0.616 . . . . 62.520000000000003 111.068 -179.712 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.603 ' HB3' HD21 ' A' ' 60' ' ' LEU . 1.2 m-20 -54.76 -39.38 68.27 Favored 'General case' 0 CA--C 1.559 1.295 0 C-N-CA 124.915 1.286 . . . . 72.400000000000006 113.223 -179.384 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 17.5 tpt180 -65.2 -44.81 87.14 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 122.512 0.325 . . . . 74.420000000000002 111.484 177.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 20' ' ' ASN . 57.7 t -67.69 -31.02 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 C-N-CA 122.787 0.435 . . . . 73.510000000000005 112.086 -176.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 87.9 mt -55.02 -56.41 11.14 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.417 0 CA-C-O 120.826 0.346 . . . . 51.020000000000003 110.432 169.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.41 HD11 ' HB3' ' A' ' 60' ' ' LEU . 68.2 mt -65.22 -28.87 69.67 Favored 'General case' 0 CA--C 1.556 1.209 0 C-N-CA 123.314 0.645 . . . . 75.299999999999997 112.198 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 61.1 tp -69.11 -48.81 61.55 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.432 0.693 . . . . 63.509999999999998 111.518 177.165 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.434 ' HA ' ' HB3' ' A' ' 31' ' ' LYS . 11.2 mm-40 -76.81 -19.19 57.84 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.115 0.566 . . . . 73.430000000000007 112.436 179.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 98.6 m -74.62 -33.25 62.53 Favored 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 112.104 0.409 . . . . 63.340000000000003 112.104 174.303 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -85.37 -24.04 27.74 Favored 'General case' 0 N--CA 1.493 1.712 0 C-N-CA 122.481 0.313 . . . . 73.129999999999995 111.413 172.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.434 ' HB3' ' HA ' ' A' ' 28' ' ' GLU . 60.6 tptt -84.26 -71.57 0.51 Allowed 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.721 0.808 . . . . 75.230000000000004 110.953 179.196 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.465 ' HD3' HG23 ' A' ' 38' ' ' THR . 39.9 ttt180 -79.11 -42.52 26.1 Favored 'General case' 0 CA--C 1.554 1.131 0 C-N-CA 124.489 1.115 . . . . 73.430000000000007 111.824 -176.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 125.62 147.66 7.02 Favored Glycine 0 CA--C 1.54 1.6 0 CA-C-O 119.317 -0.713 . . . . 42.299999999999997 112.849 179.388 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -73.75 107.48 2.42 Favored 'Trans proline' 0 C--N 1.378 2.085 0 C-N-CA 123.114 2.543 . . . . 75.010000000000005 112.118 178.696 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 48.5 t -156.1 151.24 26.5 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.419 0.688 . . . . 54.200000000000003 110.814 -178.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 64.7 p -64.13 -27.79 69.33 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 122.928 0.491 . . . . 75.430000000000007 111.32 175.167 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 40.4 tttm -72.83 -21.66 60.92 Favored 'General case' 0 CA--C 1.561 1.376 0 C-N-CA 123.986 0.914 . . . . 73.140000000000001 110.665 175.569 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.465 HG23 ' HD3' ' A' ' 32' ' ' ARG . 81.5 m -86.96 -34.37 19.34 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 124.318 1.047 . . . . 74.439999999999998 110.015 173.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.444 ' HD1' HD12 ' A' ' 42' ' ' LEU . 21.5 m-85 -71.38 -28.34 63.97 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.434 0.694 . . . . 75.120000000000005 111.836 -179.868 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.482 ' HA ' ' HG3' ' A' ' 50' ' ' PRO . . . -67.98 -32.34 72.69 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.252 0.621 . . . . 63.009999999999998 111.44 170.477 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 50.2 t80 -76.05 -38.47 57.1 Favored 'General case' 0 CA--C 1.558 1.279 0 C-N-CA 123.596 0.758 . . . . 63.130000000000003 111.291 175.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.492 HD23 ' HD2' ' A' ' 45' ' ' LYS . 68.7 mt -66.31 -29.34 69.53 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.969 0.908 . . . . 75.420000000000002 111.263 173.335 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.57 -45.07 88.62 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 123.268 0.627 . . . . 63.109999999999999 111.203 171.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -60.07 -53.58 56.09 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 123.661 0.784 . . . . 73.219999999999999 112.585 179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.583 ' HG3' ' HG ' ' A' ' 46' ' ' LEU . 0.2 OUTLIER -71.0 -40.23 71.94 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 112.889 0.7 . . . . 54.149999999999999 112.889 -175.844 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.583 ' HG ' ' HG3' ' A' ' 45' ' ' LYS . 81.6 mt -92.87 14.15 18.32 Favored 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 112.964 0.727 . . . . 74.430000000000007 112.964 -174.56 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.1 p30 51.2 22.45 1.34 Allowed 'General case' 0 N--CA 1.503 2.206 0 C-N-CA 125.951 1.7 . . . . 41.299999999999997 114.562 -176.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.409 ' HG2' ' O ' ' A' ' 46' ' ' LEU . 47.6 mmtm -101.72 -166.34 1.29 Allowed 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 123.948 0.899 . . . . 73.420000000000002 111.229 -179.587 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 14.6 m120 -127.45 146.62 59.01 Favored Pre-proline 0 CA--C 1.564 1.481 0 C-N-CA 123.259 0.624 . . . . 75.120000000000005 110.248 -179.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.482 ' HG3' ' HA ' ' A' ' 40' ' ' ALA . 59.3 Cg_exo -52.45 -38.81 74.85 Favored 'Trans proline' 0 C--N 1.389 2.668 0 C-N-CA 124.037 3.158 . . . . 74.310000000000002 115.71 -170.901 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 46.6 t-20 -59.28 -44.83 92.44 Favored 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 123.306 0.643 . . . . 62.039999999999999 110.713 177.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.436 ' NE2' HG21 ' A' ' 15' ' ' ILE . 36.9 mt-30 -67.0 -43.07 83.86 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.938 0.895 . . . . 71.129999999999995 110.777 -177.297 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.441 HG22 ' HH2' ' A' ' 17' ' ' TRP . 52.9 t -65.19 -45.81 92.77 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 CA-C-N 115.152 -0.931 . . . . 75.400000000000006 111.761 -178.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 80.8 p -64.3 -40.4 95.88 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.516 0.727 . . . . 70.120000000000005 111.724 -177.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -63.6 -49.59 72.74 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 116.043 -0.526 . . . . 62.200000000000003 111.176 172.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 10.9 tpt85 -60.83 -37.53 82.34 Favored 'General case' 0 N--CA 1.481 1.09 0 CA-C-N 115.858 -0.61 . . . . 74.230000000000004 111.466 -174.034 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 29.1 t80 -53.13 -53.65 47.37 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 124.529 1.132 . . . . 70.319999999999993 112.881 176.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 38.2 mt-30 -73.82 -24.58 59.81 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 122.906 0.482 . . . . 62.32 111.968 -175.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 82.7 mm-40 -69.97 -42.71 72.78 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.121 0.568 . . . . 64.319999999999993 109.795 170.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.603 HD21 ' HB3' ' A' ' 22' ' ' ASP . 17.7 mt -61.71 -51.99 66.1 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.736 1.214 . . . . 53.119999999999997 112.542 -178.232 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 5.7 mmt -62.08 -29.49 70.34 Favored 'General case' 0 N--CA 1.485 1.32 0 N-CA-C 112.244 0.461 . . . . 73.439999999999998 112.244 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.7 ttmp? -74.92 -46.92 32.54 Favored 'General case' 0 CA--C 1.56 1.338 0 C-N-CA 123.865 0.866 . . . . 75.230000000000004 111.921 177.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 92.6 mt -76.68 -46.62 24.92 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.448 0.699 . . . . 65.230000000000004 112.721 -177.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 48.0 t80 -62.53 -22.61 66.43 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.519 0.728 . . . . 73.420000000000002 111.57 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -57.99 -43.77 86.77 Favored 'General case' 0 CA--C 1.556 1.186 0 C-N-CA 123.618 0.767 . . . . 73.230000000000004 111.447 172.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -166.58 -57.65 0.03 OUTLIER 'General case' 0 CA--C 1.552 1.046 0 C-N-CA 123.386 0.674 . . . . 73.109999999999999 111.338 -177.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 22.0 t 60.21 -137.12 0.68 Allowed 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 124.237 1.015 . . . . 62.439999999999998 110.107 -172.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 67.3 mttm 75.8 -31.07 0.19 Allowed 'General case' 0 N--CA 1.496 1.832 0 N-CA-C 114.84 1.422 . . . . 74.450000000000003 114.84 168.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 17.4 p -81.92 67.01 7.75 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.883 0.873 . . . . 62.109999999999999 112.457 -171.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 48.9 ttt85 . . . . . 0 CA--C 1.561 1.398 0 C-N-CA 124.677 1.191 . . . . 74.340000000000003 109.45 176.764 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.2 m . . . . . 0 N--CA 1.491 1.592 0 CA-C-O 120.264 0.078 . . . . 73.430000000000007 111.044 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 90.6 m-70 -70.53 109.78 5.03 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 122.779 0.432 . . . . 75.430000000000007 110.592 177.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 87.8 mtp -68.01 109.32 3.42 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.598 0.759 . . . . 60.140000000000001 111.345 179.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -92.45 167.75 11.75 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 123.247 0.619 . . . . 63.420000000000002 111.003 176.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 6.0 p30 -114.84 139.78 49.48 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.498 0.719 . . . . 71.219999999999999 109.778 170.126 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 69.4 t -67.6 113.44 3.52 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 C-N-CA 122.983 0.513 . . . . 64.319999999999993 109.902 177.28 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 16.2 tt -71.94 81.58 0.31 Allowed 'Isoleucine or valine' 0 CA--C 1.567 1.608 0 CA-C-O 122.631 1.205 . . . . 75.409999999999997 111.888 -176.331 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.62 83.17 1.88 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.794 1.238 . . . . 73.299999999999997 109.322 176.01 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 57.9 pttt -64.58 -37.47 87.68 Favored 'General case' 0 N--CA 1.484 1.253 0 CA-C-N 114.923 -1.035 . . . . 63.43 111.649 176.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -134.79 168.71 18.54 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.795 0.838 . . . . 73.549999999999997 111.432 -179.325 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 175.79 149.0 7.17 Favored Glycine 0 CA--C 1.529 0.931 0 CA-C-N 115.448 -0.796 . . . . 75.230000000000004 111.301 179.425 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 13.6 tp10 -81.86 69.98 8.67 Favored 'General case' 0 CA--C 1.555 1.158 0 CA-C-O 121.695 0.76 . . . . 65.129999999999995 111.253 -178.209 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.502 HG22 ' H ' ' A' ' 15' ' ' ILE . 3.8 mp -127.08 114.68 38.16 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 N-CA-C 107.58 -1.267 . . . . 65.0 107.58 171.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 2.2 pp -84.7 13.23 0.75 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 C-N-CA 123.552 0.741 . . . . 72.200000000000003 112.831 -177.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.502 ' H ' HG22 ' A' ' 13' ' ' ILE . 27.1 mt -109.05 147.49 13.58 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.087 0 C-N-CA 124.994 1.318 . . . . 61.310000000000002 109.242 177.63 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 60.4 tp -63.55 119.59 10.1 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 122.898 0.479 . . . . 61.039999999999999 110.087 171.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 86.4 m95 -147.79 138.3 23.1 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 124.41 1.084 . . . . 74.329999999999998 110.547 176.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 25.1 p -119.98 159.1 25.39 Favored 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 123.93 0.892 . . . . 61.43 110.259 177.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 8.7 ptp85 -64.29 -20.75 66.29 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 123.704 0.802 . . . . 64.439999999999998 112.205 174.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -67.7 -44.88 76.69 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.933 0.893 . . . . 73.540000000000006 110.312 173.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -59.48 -44.95 92.92 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 123.495 0.718 . . . . 74.109999999999999 111.772 177.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.41 ' HB3' HD21 ' A' ' 60' ' ' LEU . 61.4 m-20 -54.33 -44.13 71.81 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 124.859 1.264 . . . . 71.420000000000002 112.66 179.69 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 61.2 ttp180 -59.62 -43.68 93.7 Favored 'General case' 0 CA--C 1.556 1.184 0 CA-C-N 115.823 -0.626 . . . . 74.340000000000003 111.563 177.044 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.6 t -69.28 -38.95 78.45 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.283 0 C-N-CA 123.582 0.753 . . . . 73.120000000000005 111.534 -177.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 90.2 mt -63.72 -52.24 59.78 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 C-N-CA 122.819 0.447 . . . . 53.399999999999999 111.012 177.697 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.407 ' HG ' HD13 ' A' ' 60' ' ' LEU . 97.6 mt -58.43 -34.92 71.33 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.129 0.572 . . . . 65.530000000000001 111.813 175.437 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 35.2 tp -63.48 -55.28 25.37 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.183 0.593 . . . . 72.140000000000001 111.121 178.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 54.6 mm-40 -72.43 -23.77 61.12 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 112.874 0.694 . . . . 64.549999999999997 112.874 -176.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 91.3 m -69.71 -30.01 67.54 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 122.719 0.408 . . . . 53.130000000000003 111.238 175.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -86.69 -33.31 20.09 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 123.601 0.76 . . . . 75.340000000000003 111.8 174.707 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 50.9 mtpt -75.16 -74.9 0.19 Allowed 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 123.493 0.717 . . . . 60.229999999999997 111.651 178.524 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 27.2 mtp180 -79.91 -36.93 35.7 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 124.175 0.99 . . . . 63.310000000000002 110.353 -172.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 122.07 160.4 10.95 Favored Glycine 0 CA--C 1.538 1.497 0 CA-C-N 115.363 -0.835 . . . . 52.439999999999998 111.967 -176.425 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -77.64 38.24 0.66 Allowed 'Trans proline' 0 CA--C 1.563 1.937 0 C-N-CA 123.568 2.845 . . . . 53.200000000000003 113.593 176.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 34.8 t -75.7 154.24 36.58 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.709 0.804 . . . . 62.439999999999998 111.788 179.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 98.3 p -61.33 -34.53 75.41 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.847 0.859 . . . . 70.299999999999997 111.877 178.092 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt -74.46 -19.51 60.36 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 123.256 0.622 . . . . 55.32 112.015 177.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 51.6 m -78.17 -33.91 49.91 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 109.183 -0.673 . . . . 65.439999999999998 109.183 173.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.8 m-85 -70.64 -30.96 67.72 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.429 0.692 . . . . 72.219999999999999 111.245 173.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -68.96 -36.12 77.53 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.339 0.656 . . . . 55.100000000000001 111.566 171.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 82.4 t80 -63.57 -48.68 76.46 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 123.303 0.641 . . . . 73.349999999999994 110.704 171.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.453 ' HB2' HG11 ' A' ' 53' ' ' VAL . 59.9 mt -66.77 -23.05 66.03 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 124.603 1.161 . . . . 71.239999999999995 112.303 178.218 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.87 -53.52 49.18 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.102 0.561 . . . . 73.329999999999998 111.172 171.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -71.54 -28.21 63.72 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.09 0.556 . . . . 64.099999999999994 112.436 179.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.408 ' HE3' ' HA ' ' A' ' 45' ' ' LYS . 0.2 OUTLIER -72.8 -47.32 47.52 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.508 0.723 . . . . 72.329999999999998 111.247 178.686 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 52.1 mt -101.22 5.22 42.48 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.449 0.7 . . . . 71.239999999999995 112.444 -172.14 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 19.5 m-20 61.65 29.67 18.25 Favored 'General case' 0 N--CA 1.496 1.843 0 C-N-CA 124.304 1.042 . . . . 42.310000000000002 112.217 -177.008 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.0 mmtm -104.0 -165.81 1.19 Allowed 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 124.565 1.146 . . . . 73.409999999999997 110.434 178.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 12.0 m120 -119.96 145.59 40.09 Favored Pre-proline 0 N--CA 1.489 1.49 0 CA-C-O 118.36 -0.829 . . . . 71.340000000000003 110.43 178.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -50.78 -46.03 32.44 Favored 'Trans proline' 0 C--N 1.385 2.487 0 C-N-CA 123.638 2.892 . . . . 75.019999999999996 114.801 -174.395 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -66.31 -41.59 89.47 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.643 0.777 . . . . 55.25 111.13 179.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -67.22 -34.7 78.03 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.725 0.81 . . . . 72.549999999999997 111.995 -178.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.453 HG11 ' HB2' ' A' ' 42' ' ' LEU . 60.6 t -71.77 -38.9 67.52 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 C-N-CA 123.016 0.526 . . . . 74.530000000000001 110.583 174.041 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 23.2 t -59.91 -44.46 94.26 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.954 0.901 . . . . 35.310000000000002 111.093 177.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 53.2 mm-40 -63.65 -43.9 95.39 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.06 0.544 . . . . 64.400000000000006 110.986 173.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 23.5 tpt180 -63.68 -35.22 79.82 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 123.629 0.772 . . . . 55.100000000000001 112.666 -176.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 17.2 t80 -54.71 -47.47 73.69 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.601 0.761 . . . . 74.0 110.873 171.197 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 74.5 mt-30 -73.95 -24.29 59.62 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 115.191 -0.913 . . . . 74.450000000000003 112.04 -178.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.433 ' O ' ' HG ' ' A' ' 63' ' ' LEU . 17.4 mm-40 -70.19 -38.04 75.24 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.111 0.564 . . . . 73.310000000000002 110.173 172.166 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.41 HD21 ' HB3' ' A' ' 22' ' ' ASP . 31.7 mt -60.87 -53.55 56.0 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.179 0.992 . . . . 72.349999999999994 111.577 175.03 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 90.1 mmm -62.7 -31.28 72.16 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 122.954 0.502 . . . . 63.329999999999998 111.651 178.422 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -65.24 -33.4 75.91 Favored 'General case' 0 CA--C 1.558 1.283 0 C-N-CA 124.238 1.015 . . . . 63.509999999999998 111.541 174.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 59' ' ' GLN . 94.6 mt -73.83 -34.05 64.4 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 123.215 0.606 . . . . 64.510000000000005 111.41 173.799 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -65.8 -33.46 75.92 Favored 'General case' 0 N--CA 1.494 1.773 0 C-N-CA 123.603 0.761 . . . . 71.349999999999994 111.395 175.138 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -69.66 -30.46 68.16 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.577 0.751 . . . . 73.430000000000007 111.665 174.054 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 45.2 mtmt 74.19 -60.5 0.52 Allowed 'General case' 0 N--CA 1.499 1.984 0 C-N-CA 125.595 1.558 . . . . 73.319999999999993 114.2 172.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 48.0 t -81.93 114.35 20.47 Favored 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 113.754 1.02 . . . . 64.209999999999994 113.754 -169.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.32 41.42 2.95 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 124.772 1.229 . . . . 75.409999999999997 109.48 168.322 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 49.3 t 77.27 -22.14 0.3 Allowed 'General case' 0 N--CA 1.499 2.002 0 C-N-CA 125.947 1.699 . . . . 73.129999999999995 114.061 177.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 14.6 mmp_? . . . . . 0 N--CA 1.493 1.676 0 C-N-CA 123.371 0.668 . . . . 74.530000000000001 111.37 177.919 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 46.0 t . . . . . 0 N--CA 1.483 1.208 0 N-CA-C 110.466 -0.198 . . . . 75.510000000000005 110.466 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 78.9 t60 64.73 146.78 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 125.128 1.371 . . . . 72.219999999999999 113.106 178.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.414 ' SD ' ' N ' ' A' ' 3' ' ' MET . 3.2 mpp? -71.84 86.04 0.96 Allowed 'General case' 0 N--CA 1.48 1.025 0 CA-C-O 121.24 0.543 . . . . 62.219999999999999 109.629 171.222 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.625 ' HD3' ' H ' ' A' ' 4' ' ' LYS . 0.0 OUTLIER -69.68 -175.72 0.92 Allowed 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 124.011 0.925 . . . . 75.340000000000003 112.687 -176.883 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 64.28 29.47 13.72 Favored 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 124.334 1.054 . . . . 75.209999999999994 111.377 -172.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 15.8 m -68.9 -30.92 48.53 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.407 0 N-CA-C 112.647 0.61 . . . . 74.239999999999995 112.647 178.167 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.506 HD12 ' H ' ' A' ' 7' ' ' ILE . 2.8 mp -81.05 133.18 29.87 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.31 0 N-CA-C 109.41 -0.589 . . . . 72.239999999999995 109.41 176.772 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 1.2 mptm? -76.75 156.5 32.36 Favored 'General case' 0 N--CA 1.488 1.446 0 CA-C-O 121.516 0.674 . . . . 74.109999999999999 111.515 176.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.96 29.32 1.62 Allowed 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 124.171 0.988 . . . . 75.420000000000002 110.908 -174.059 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 88.3 tttt 69.85 -67.92 0.21 Allowed 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 125.385 1.474 . . . . 64.439999999999998 111.694 -175.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -131.51 -178.19 15.33 Favored Glycine 0 N--CA 1.477 1.376 0 C-N-CA 122.987 0.327 . . . . 71.219999999999999 112.657 176.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -79.4 101.49 8.17 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 122.912 0.485 . . . . 73.230000000000004 110.253 177.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.521 ' HB ' HH21 ' A' ' 56' ' ' ARG . 18.4 pt -90.93 104.6 15.58 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.354 0 CA-C-O 121.708 0.766 . . . . 45.32 110.954 -179.203 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 47.4 mt -73.18 -23.74 20.21 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 C-N-CA 123.92 0.888 . . . . 72.439999999999998 112.425 -172.736 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 69.7 mt -64.48 138.5 22.99 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.35 0 C-N-CA 123.177 0.591 . . . . 70.530000000000001 110.486 174.31 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.8 mp -63.94 100.62 0.32 Allowed 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.155 0.582 . . . . 72.030000000000001 112.059 -177.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . 0.464 ' CH2' ' HG3' ' A' ' 48' ' ' LYS . 96.8 m95 -125.03 121.31 33.99 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.58 0.752 . . . . 73.109999999999999 110.238 176.722 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 82.1 p -128.75 170.22 13.57 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 123.345 0.658 . . . . 62.409999999999997 111.304 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 39.5 ptt180 -52.76 -29.71 28.75 Favored 'General case' 0 N--CA 1.494 1.752 0 C-N-CA 124.807 1.243 . . . . 72.540000000000006 113.576 -175.054 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.442 ' O ' HG23 ' A' ' 24' ' ' VAL . 18.3 m120 -77.87 -44.46 27.09 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 123.284 0.634 . . . . 75.310000000000002 111.714 177.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -59.5 -49.78 76.46 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 122.983 0.513 . . . . 54.119999999999997 111.582 -178.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.682 ' HB2' HD21 ' A' ' 60' ' ' LEU . 2.9 p30 -68.72 -32.45 72.26 Favored 'General case' 0 CA--C 1.558 1.282 0 CA-C-N 115.519 -0.764 . . . . 71.310000000000002 112.243 -177.769 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -63.85 -37.41 87.28 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 123.302 0.641 . . . . 75.439999999999998 111.296 173.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 20' ' ' ASN . 86.4 t -69.0 -38.03 77.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 C-N-CA 123.242 0.617 . . . . 73.129999999999995 111.298 176.338 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.404 HD11 ' CZ3' ' A' ' 17' ' ' TRP . 81.9 mt -55.96 -57.49 8.15 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.447 0 C-N-CA 122.439 0.295 . . . . 73.219999999999999 110.243 173.657 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.515 ' HG ' HD13 ' A' ' 60' ' ' LEU . 96.0 mt -60.12 -36.52 77.66 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.638 0.775 . . . . 72.319999999999993 112.517 178.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 42.5 tp -59.61 -59.07 6.03 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.138 0.575 . . . . 72.219999999999999 110.701 -179.006 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 39.4 mm-40 -70.69 -25.54 63.02 Favored 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 123.338 0.655 . . . . 71.329999999999998 112.536 -179.552 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 90.4 m -73.66 -36.79 65.41 Favored 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 112.353 0.501 . . . . 61.420000000000002 112.353 178.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -81.5 -30.71 33.19 Favored 'General case' 0 N--CA 1.492 1.627 0 CA-C-O 121.378 0.609 . . . . 71.219999999999999 111.03 176.112 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -72.17 -46.66 55.44 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 125.147 1.379 . . . . 70.439999999999998 112.522 178.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 53.3 mtp180 -114.78 -25.08 8.39 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 123.91 0.884 . . . . 55.140000000000001 112.722 -170.353 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 108.65 129.13 5.87 Favored Glycine 0 N--CA 1.479 1.52 0 CA-C-O 118.915 -0.936 . . . . 41.350000000000001 111.879 -173.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 76.5 Cg_endo -74.2 85.43 1.4 Allowed 'Trans proline' 0 C--N 1.377 2.053 0 C-N-CA 122.618 2.212 . . . . 64.319999999999993 112.684 179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 18.0 t -141.19 -179.24 5.99 Favored 'General case' 0 N--CA 1.482 1.159 0 CA-C-N 115.42 -0.809 . . . . 75.450000000000003 110.496 178.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 84.0 p -58.8 -36.44 74.45 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 114.156 1.169 . . . . 74.140000000000001 114.156 -169.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -70.0 -27.49 64.74 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 123.004 0.522 . . . . 73.0 111.866 -178.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 70.4 m -85.66 -43.76 13.16 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.437 0.695 . . . . 63.049999999999997 109.987 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -67.84 -29.29 68.39 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.363 0.665 . . . . 75.109999999999999 112.051 178.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.19 -39.92 90.03 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 122.918 0.487 . . . . 75.5 111.211 173.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 66.8 t80 -65.41 -51.09 62.75 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-N 116.077 -0.511 . . . . 72.200000000000003 110.686 174.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 79.4 mt -59.64 -31.02 69.14 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 124.362 1.065 . . . . 75.349999999999994 112.56 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.71 -56.04 14.18 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.344 0.657 . . . . 72.150000000000006 111.022 172.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.82 -25.8 68.07 Favored 'General case' 0 CA--C 1.56 1.363 0 C-N-CA 123.655 0.782 . . . . 50.009999999999998 112.617 178.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -76.89 -52.11 10.04 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 124.124 0.97 . . . . 74.219999999999999 111.34 -177.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.413 ' HB2' ' HG2' ' A' ' 48' ' ' LYS . 51.4 mt -91.19 -2.42 57.51 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 124.082 0.953 . . . . 61.149999999999999 111.904 -176.141 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.5 t70 69.25 33.5 3.25 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 125.312 1.445 . . . . 71.409999999999997 111.425 -177.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.464 ' HG3' ' CH2' ' A' ' 17' ' ' TRP . 67.9 mmtt -105.33 -167.18 1.3 Allowed 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 124.489 1.116 . . . . 74.329999999999998 110.749 177.289 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 12.2 m120 -118.71 149.04 45.63 Favored Pre-proline 0 N--CA 1.489 1.523 0 C-N-CA 123.751 0.82 . . . . 72.400000000000006 109.996 171.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 74.7 Cg_exo -51.36 -42.1 56.27 Favored 'Trans proline' 0 C--N 1.387 2.556 0 C-N-CA 123.689 2.926 . . . . 73.219999999999999 115.761 -172.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -65.27 -39.73 93.0 Favored 'General case' 0 N--CA 1.494 1.733 0 C-N-CA 122.621 0.368 . . . . 74.310000000000002 111.437 177.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.443 ' O ' ' HD3' ' A' ' 56' ' ' ARG . 79.7 mt-30 -65.79 -31.18 72.01 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.552 0.741 . . . . 72.040000000000006 111.234 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 95.7 t -74.89 -46.95 39.28 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.145 0 C-N-CA 123.517 0.727 . . . . 72.120000000000005 111.016 175.168 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 35.0 t -64.73 -36.13 83.3 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 124.103 0.961 . . . . 74.349999999999994 112.801 -174.438 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -71.94 -39.31 69.5 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 122.671 0.388 . . . . 70.420000000000002 111.874 177.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.521 HH21 ' HB ' ' A' ' 13' ' ' ILE . 5.7 mpt_? -69.53 -29.39 66.98 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 122.647 0.379 . . . . 64.040000000000006 111.026 176.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.48 ' HA ' HD12 ' A' ' 60' ' ' LEU . 8.2 t80 -55.37 -43.8 75.46 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.705 0.802 . . . . 75.439999999999998 111.019 168.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -74.75 -25.13 58.88 Favored 'General case' 0 CA--C 1.558 1.257 0 C-N-CA 123.47 0.708 . . . . 71.409999999999997 112.38 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -74.36 -31.85 62.55 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.346 0.593 . . . . 64.049999999999997 110.244 171.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.682 HD21 ' HB2' ' A' ' 22' ' ' ASP . 38.6 mt -65.83 -34.82 79.03 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.189 0.996 . . . . 72.239999999999995 111.482 172.621 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 33.8 mmt -62.72 -31.7 72.67 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.008 0.523 . . . . 74.109999999999999 111.564 175.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 58.3 mmtt -71.69 -29.92 65.11 Favored 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 112.695 0.628 . . . . 70.209999999999994 112.695 174.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.468 HD12 HD23 ' A' ' 60' ' ' LEU . 51.3 mt -62.46 -40.42 96.59 Favored 'General case' 0 N--CA 1.485 1.322 0 CA-C-O 121.076 0.465 . . . . 75.219999999999999 110.501 173.017 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 65.3 m-85 -76.64 -30.25 56.78 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 123.576 0.751 . . . . 74.439999999999998 112.36 176.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -66.91 -61.55 1.89 Allowed 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.396 0.678 . . . . 64.349999999999994 110.858 -176.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.451 ' NZ ' ' HB3' ' A' ' 66' ' ' LYS . 4.2 ttpm? -177.03 151.76 0.85 Allowed 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 123.21 0.604 . . . . 74.439999999999998 110.814 -173.384 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.432 ' HA ' HG13 ' A' ' 7' ' ' ILE . 49.0 m -71.52 141.17 50.13 Favored 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 109.969 -0.382 . . . . 70.329999999999998 109.969 166.03 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 59.7 mttm 72.76 155.18 0.16 Allowed 'General case' 0 N--CA 1.497 1.923 0 C-N-CA 125.071 1.349 . . . . 71.299999999999997 112.331 -177.079 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 44.2 t -67.26 -67.13 0.48 Allowed 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 123.469 0.708 . . . . 64.450000000000003 111.258 -178.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.565 1.539 0 C-N-CA 122.991 0.517 . . . . 61.32 111.786 176.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 45.6 m . . . . . 0 N--CA 1.495 1.784 0 N-CA-C 111.3 0.111 . . . . 73.239999999999995 111.3 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 63.6 m80 62.5 -154.58 0.34 Allowed 'General case' 0 N--CA 1.496 1.827 0 C-N-CA 124.281 1.032 . . . . 61.149999999999999 111.342 -178.163 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.508 ' HG3' HH22 ' A' ' 19' ' ' ARG . 38.5 tpp 65.45 88.41 0.11 Allowed 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 124.639 1.176 . . . . 62.130000000000003 111.417 177.159 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 35.6 ttmt -154.75 15.15 0.43 Allowed 'General case' 0 CA--C 1.563 1.452 0 C-N-CA 123.827 0.851 . . . . 53.299999999999997 110.293 -177.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 46.5 t-20 -72.09 92.65 1.34 Allowed 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 123.602 0.761 . . . . 62.229999999999997 110.871 -174.154 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 30.1 m -107.59 128.11 63.0 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 123.593 0.757 . . . . 54.219999999999999 110.449 176.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.3 mp -93.3 104.44 15.74 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.975 0 C-N-CA 123.548 0.739 . . . . 74.540000000000006 109.344 179.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 56.9 tptt 57.34 86.68 0.07 Allowed 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 124.286 1.034 . . . . 70.219999999999999 112.181 177.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -68.68 109.55 3.86 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-O 121.304 0.573 . . . . 61.109999999999999 111.584 -178.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -98.82 95.77 7.42 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.032 0.933 . . . . 70.200000000000003 110.013 177.464 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 151.28 76.13 0.02 OUTLIER Glycine 0 CA--C 1.531 1.087 0 CA-C-N 116.343 -0.39 . . . . 64.329999999999998 113.454 177.345 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -71.22 103.47 2.82 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 122.898 0.479 . . . . 64.129999999999995 110.247 170.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 4.3 pt -128.98 116.35 40.33 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.118 0 C-N-CA 124.09 0.956 . . . . 62.420000000000002 111.153 -175.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 14.9 tt -64.42 -18.45 23.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 C-N-CA 124.464 1.106 . . . . 71.310000000000002 112.777 -178.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.603 HD12 ' H ' ' A' ' 15' ' ' ILE . 3.6 mp -68.82 -19.98 24.5 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.58 0 C-N-CA 124.364 1.065 . . . . 64.340000000000003 111.727 -175.83 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 56.7 tp 63.71 75.03 0.4 Allowed 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 124.631 1.172 . . . . 71.150000000000006 111.153 -177.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 82.4 m95 -99.66 113.09 25.32 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 116.001 -0.545 . . . . 75.439999999999998 110.802 176.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 30.1 p -97.03 155.95 16.57 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 108.324 -0.991 . . . . 65.019999999999996 108.324 171.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.508 HH22 ' HG3' ' A' ' 3' ' ' MET . 35.3 ptt180 -58.93 -20.31 50.82 Favored 'General case' 0 CA--C 1.558 1.253 0 N-CA-C 112.237 0.458 . . . . 74.120000000000005 112.237 176.116 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 12.8 m120 -71.19 -40.49 71.19 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 123.969 0.908 . . . . 62.340000000000003 111.472 175.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.436 ' HA ' HD22 ' A' ' 46' ' ' LEU . 28.9 m-20 -60.54 -61.65 2.43 Favored 'General case' 0 N--CA 1.487 1.378 0 CA-C-O 121.49 0.662 . . . . 75.140000000000001 111.281 176.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.576 ' HB2' HD11 ' A' ' 60' ' ' LEU . 1.7 p30 -64.91 -28.67 69.69 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 113.624 0.972 . . . . 63.409999999999997 113.624 -174.231 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 28.2 tpt85 -56.21 -38.67 71.34 Favored 'General case' 0 CA--C 1.558 1.285 0 C-N-CA 123.03 0.532 . . . . 73.150000000000006 111.921 173.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 44.0 t -72.9 -31.54 36.4 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 123.332 0.653 . . . . 73.349999999999994 111.184 177.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 66.0 mt -59.86 -47.19 92.45 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 C-N-CA 122.527 0.331 . . . . 65.109999999999999 110.34 172.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.411 HD21 ' HB3' ' A' ' 60' ' ' LEU . 97.4 mt -56.26 -38.96 71.86 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 123.741 0.817 . . . . 71.140000000000001 112.002 175.181 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 57.8 tp -63.81 -59.17 4.88 Favored 'General case' 0 CA--C 1.556 1.175 0 C-N-CA 123.419 0.688 . . . . 72.519999999999996 111.739 179.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -69.95 -22.15 63.2 Favored 'General case' 0 N--CA 1.487 1.385 0 N-CA-C 113.236 0.828 . . . . 63.219999999999999 113.236 -175.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 65.7 m -69.8 -30.09 67.54 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 122.458 0.303 . . . . 43.329999999999998 111.415 173.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -84.19 -39.17 19.69 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 122.965 0.506 . . . . 75.319999999999993 111.026 174.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 72.5 mmtt -61.44 -64.36 0.97 Allowed 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.975 0.91 . . . . 75.540000000000006 111.789 178.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.49 ' HD2' HG23 ' A' ' 38' ' ' THR . 37.5 mtt-85 -91.07 -52.19 4.96 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.74 0.816 . . . . 70.549999999999997 110.976 -174.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 131.08 147.1 5.97 Favored Glycine 0 CA--C 1.534 1.249 0 CA-C-N 115.157 -0.929 . . . . 34.109999999999999 111.391 -173.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -61.06 95.61 0.12 Allowed 'Trans proline' 0 C--N 1.374 1.869 0 C-N-CA 122.894 2.396 . . . . 73.420000000000002 112.445 175.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 48.3 t -146.95 157.06 43.52 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.985 0.914 . . . . 72.140000000000001 110.531 -175.588 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 81.0 p -65.34 -31.94 73.33 Favored 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 123.457 0.703 . . . . 73.530000000000001 112.407 -177.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -69.95 -26.66 64.22 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 123.286 0.634 . . . . 72.340000000000003 111.726 174.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.49 HG23 ' HD2' ' A' ' 32' ' ' ARG . 97.3 m -77.97 -42.99 31.01 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.759 0.823 . . . . 72.099999999999994 109.152 177.161 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -63.86 -28.81 70.1 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 124.028 0.931 . . . . 73.040000000000006 111.318 173.285 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.556 ' HA ' ' HG3' ' A' ' 50' ' ' PRO . . . -69.24 -42.35 75.75 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.372 0.669 . . . . 45.140000000000001 111.522 175.705 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -59.71 -49.41 77.84 Favored 'General case' 0 N--CA 1.483 1.211 0 CA-C-O 121.077 0.465 . . . . 70.129999999999995 110.51 171.658 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 64.9 mt -63.74 -23.97 67.58 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.537 1.135 . . . . 74.230000000000004 112.741 178.495 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.77 -53.95 33.66 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.127 0.571 . . . . 73.120000000000005 110.727 172.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.27 -35.29 80.58 Favored 'General case' 0 CA--C 1.557 1.226 0 C-N-CA 123.308 0.643 . . . . 25.399999999999999 111.635 177.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 58.2 tptt -66.93 -49.7 64.71 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.542 1.137 . . . . 75.420000000000002 111.693 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.436 HD22 ' HA ' ' A' ' 21' ' ' ASP . 64.9 mt -96.1 -2.15 47.14 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 113.013 0.746 . . . . 45.43 113.013 -172.715 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 79.88 -1.21 2.1 Favored 'General case' 0 N--CA 1.505 2.312 0 C-N-CA 126.117 1.767 . . . . 74.420000000000002 113.398 -178.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.4 mptt -88.88 -168.02 2.06 Favored 'General case' 0 N--CA 1.492 1.629 0 N-CA-C 112.31 0.485 . . . . 64.010000000000005 112.31 -179.532 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 38.6 m-80 -108.43 152.73 42.17 Favored Pre-proline 0 N--CA 1.484 1.248 0 C-N-CA 124.229 1.012 . . . . 75.040000000000006 110.126 173.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.556 ' HG3' ' HA ' ' A' ' 40' ' ' ALA . 37.4 Cg_exo -57.17 -34.17 97.26 Favored 'Trans proline' 0 C--N 1.39 2.72 0 C-N-CA 123.439 2.759 . . . . 74.209999999999994 114.203 -172.37 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.423 ' O ' ' HG3' ' A' ' 55' ' ' GLU . 18.3 m120 -67.78 -39.75 84.06 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.372 0.669 . . . . 65.239999999999995 111.497 177.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 34.8 mt-30 -66.33 -42.22 88.49 Favored 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 123.225 0.61 . . . . 73.239999999999995 110.453 177.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 82.0 t -57.58 -41.15 78.47 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 124.314 1.046 . . . . 65.049999999999997 111.049 173.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.499 ' O ' ' HG3' ' A' ' 58' ' ' GLN . 34.3 t -65.59 -41.25 93.05 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.152 0.581 . . . . 70.120000000000005 111.503 178.422 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.423 ' HG3' ' O ' ' A' ' 51' ' ' ASN . 52.0 mt-10 -57.98 -49.55 76.44 Favored 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 123.049 0.54 . . . . 60.420000000000002 111.142 176.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.4 tpm_? -62.16 -39.1 91.5 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 124.169 0.988 . . . . 71.510000000000005 111.818 176.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.415 ' HA ' HD12 ' A' ' 60' ' ' LEU . 16.0 t80 -56.14 -49.77 73.01 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 124.59 1.156 . . . . 71.019999999999996 112.252 177.288 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.499 ' HG3' ' O ' ' A' ' 54' ' ' SER . 62.3 mt-30 -68.59 -25.83 65.07 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.479 0.711 . . . . 73.109999999999999 111.439 -176.391 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 71.2 mt-30 -71.31 -47.73 54.96 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 115.427 -0.806 . . . . 71.239999999999995 109.668 171.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.576 HD11 ' HB2' ' A' ' 22' ' ' ASP . 58.2 mt -52.93 -46.65 68.2 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 124.497 1.119 . . . . 55.210000000000001 112.603 178.34 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 33.9 mmt -56.43 -48.48 76.91 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.102 0.561 . . . . 75.030000000000001 111.822 -179.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 85.4 tttt -75.55 -35.6 60.63 Favored 'General case' 0 CA--C 1.559 1.312 0 N-CA-C 112.783 0.66 . . . . 73.409999999999997 112.783 -176.276 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 97.1 mt -73.07 -38.18 66.54 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 123.258 0.623 . . . . 44.43 111.554 179.322 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -72.19 -36.43 69.22 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.466 0.706 . . . . 75.319999999999993 110.538 179.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -69.85 -37.12 76.04 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.04 0.936 . . . . 64.5 111.308 173.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 84.3 tttt 74.29 -29.06 0.19 Allowed 'General case' 0 CA--C 1.566 1.595 0 C-N-CA 125.787 1.635 . . . . 71.239999999999995 114.045 177.182 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 88.2 p -64.62 149.21 49.35 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 113.045 0.758 . . . . 74.140000000000001 113.045 -172.176 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.518 ' HG2' ' H ' ' A' ' 69' ' ' CYS . 73.2 tttt -108.84 -151.5 0.47 Allowed 'General case' 0 CA--C 1.568 1.665 0 C-N-CA 123.933 0.893 . . . . 62.140000000000001 109.298 -177.569 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.518 ' H ' ' HG2' ' A' ' 68' ' ' LYS . 62.4 m 73.18 -15.74 0.52 Allowed 'General case' 0 N--CA 1.501 2.076 0 C-N-CA 125.1 1.36 . . . . 51.450000000000003 113.737 178.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 21.1 mtm180 . . . . . 0 CA--C 1.565 1.55 0 C-N-CA 124.125 0.97 . . . . 72.140000000000001 110.042 179.905 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 33.2 m . . . . . 0 N--CA 1.486 1.359 0 N-CA-C 110.706 -0.109 . . . . 40.25 110.706 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 85.1 m-70 -136.53 137.06 39.89 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 123.461 0.704 . . . . 73.109999999999999 111.009 177.828 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 22.9 ptp -134.08 145.2 49.15 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 123.49 0.716 . . . . 70.209999999999994 110.598 177.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -79.67 96.77 6.3 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.28 0.632 . . . . 72.409999999999997 110.121 178.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -81.29 70.98 8.26 Favored 'General case' 0 N--CA 1.484 1.248 0 CA-C-O 121.721 0.772 . . . . 74.439999999999998 111.271 -179.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 10.2 m -84.63 102.29 10.37 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.002 0 CA-C-N 115.493 -0.776 . . . . 53.299999999999997 109.824 177.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 34.1 pt -77.5 -27.72 15.76 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 C-N-CA 123.815 0.846 . . . . 65.450000000000003 113.019 -168.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.582 ' HG3' ' HB3' ' A' ' 63' ' ' LEU . 42.9 mmtm 69.75 140.87 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 125.263 1.425 . . . . 72.25 113.261 -173.357 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 64.7 tttp -65.01 114.49 4.61 Favored 'General case' 0 CA--C 1.552 1.045 0 CA-C-N 115.223 -0.899 . . . . 73.0 109.539 168.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.49 ' HE3' ' HA ' ' A' ' 10' ' ' LYS . 0.0 OUTLIER -66.83 124.14 22.11 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.316 0.646 . . . . 72.109999999999999 111.544 -179.077 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -68.63 165.53 47.46 Favored Glycine 0 CA--C 1.534 1.281 0 CA-C-N 116.428 -0.351 . . . . 71.340000000000003 112.556 170.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -68.48 95.6 0.64 Allowed 'General case' 0 N--CA 1.481 1.093 0 CA-C-O 121.513 0.673 . . . . 72.230000000000004 111.284 -178.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.57 HG22 ' H ' ' A' ' 15' ' ' ILE . 41.3 mm -107.98 131.89 57.13 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.99 0 CA-C-N 115.47 -0.787 . . . . 70.299999999999997 109.202 175.834 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 41.5 pt -82.63 -6.43 10.0 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 C-N-CA 123.308 0.643 . . . . 64.530000000000001 112.585 -176.466 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.57 ' H ' HG22 ' A' ' 13' ' ' ILE . 56.0 mt -110.76 146.92 15.27 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 C-N-CA 123.675 0.79 . . . . 54.119999999999997 111.013 -178.629 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 63.0 tp -62.09 104.66 0.49 Allowed 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 124.426 1.09 . . . . 72.329999999999998 111.171 175.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 95.4 m95 -131.28 120.56 23.36 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.823 0.849 . . . . 65.040000000000006 110.025 176.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 27.1 p -106.03 166.88 10.18 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.2 0.6 . . . . 65.349999999999994 109.845 179.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.47 -20.77 66.39 Favored 'General case' 0 CA--C 1.552 1.048 0 CA-C-N 115.923 -0.58 . . . . 74.120000000000005 112.461 175.784 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -73.13 -43.33 61.78 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.651 0.78 . . . . 63.409999999999997 110.66 173.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -57.84 -44.95 86.82 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.893 0.477 . . . . 74.129999999999995 110.848 171.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 -56.64 -53.13 61.19 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 124.111 0.964 . . . . 73.209999999999994 111.511 176.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 19.8 tpp180 -55.64 -47.76 76.11 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.911 0.884 . . . . 74.150000000000006 111.636 179.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 82.2 t -66.64 -43.7 90.2 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.152 0 C-N-CA 122.936 0.494 . . . . 72.420000000000002 112.137 -177.438 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 73.4 mt -56.79 -53.01 47.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 CA-C-N 118.324 0.511 . . . . 74.439999999999998 111.18 175.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.418 HD11 HD22 ' A' ' 60' ' ' LEU . 73.3 mt -61.25 -37.49 83.28 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 123.789 0.836 . . . . 74.409999999999997 112.231 -179.53 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 36.2 tp -73.78 -58.15 3.5 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.336 0.654 . . . . 62.229999999999997 111.734 -176.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.601 ' HB2' HD21 ' A' ' 42' ' ' LEU . 4.2 mm-40 -66.89 -23.51 66.01 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 123.141 0.576 . . . . 74.129999999999995 112.1 -175.286 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 99.2 m -70.77 -29.92 66.26 Favored 'General case' 0 N--CA 1.493 1.715 0 C-N-CA 122.932 0.493 . . . . 73.230000000000004 111.742 172.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -77.58 -25.89 50.34 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.874 -0.517 . . . . 74.340000000000003 111.438 172.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 1.1 mpmm? -76.17 -62.74 1.51 Allowed 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 123.59 0.756 . . . . 72.25 111.633 178.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 7.4 mpt_? -93.13 -2.73 55.09 Favored 'General case' 0 N--CA 1.49 1.525 0 N-CA-C 112.826 0.676 . . . . 73.200000000000003 112.826 -174.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 92.73 146.22 18.6 Favored Glycine 0 N--CA 1.487 2.041 0 CA-C-O 119.095 -0.836 . . . . 65.299999999999997 112.602 -173.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -77.49 43.05 1.25 Allowed 'Trans proline' 0 C--N 1.376 1.991 0 C-N-CA 123.373 2.715 . . . . 64.519999999999996 113.543 -177.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 42.6 m -97.35 168.68 10.26 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.18 0.992 . . . . 61.43 111.543 -177.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.429 ' HA ' ' HD2' ' A' ' 39' ' ' PHE . 89.9 p -61.1 -30.87 70.62 Favored 'General case' 0 N--CA 1.499 1.99 0 C-N-CA 123.35 0.66 . . . . 75.200000000000003 112.26 179.282 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 62.3 tttm -58.45 -28.24 65.11 Favored 'General case' 0 CA--C 1.559 1.318 0 C-N-CA 124.392 1.077 . . . . 71.310000000000002 112.165 175.252 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 59.4 m -93.26 -34.23 13.64 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.524 0.73 . . . . 73.329999999999998 110.959 -178.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . 0.429 ' HD2' ' HA ' ' A' ' 36' ' ' SER . 33.8 m-85 -62.54 -33.69 75.43 Favored 'General case' 0 N--CA 1.489 1.518 0 CA-C-O 121.153 0.501 . . . . 74.519999999999996 111.418 174.271 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -65.16 -41.36 94.78 Favored 'General case' 0 CA--C 1.557 1.234 0 C-N-CA 123.693 0.797 . . . . 73.219999999999999 111.493 173.22 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 77.0 t80 -62.34 -52.33 64.09 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.825 0.85 . . . . 64.129999999999995 111.209 174.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.601 HD21 ' HB2' ' A' ' 28' ' ' GLU . 80.7 mt -60.24 -31.37 70.13 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 125.094 1.357 . . . . 75.329999999999998 113.031 -178.764 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -60.37 -53.37 58.4 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.326 0.65 . . . . 70.549999999999997 111.639 175.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.56 -27.76 62.41 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 122.859 0.463 . . . . 22.23 111.968 177.031 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -72.66 -30.51 64.34 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 124.153 0.981 . . . . 74.209999999999994 111.787 -178.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 97.0 mt -116.33 4.66 13.46 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.618 0.767 . . . . 52.219999999999999 112.427 -177.36 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 61.34 27.53 17.16 Favored 'General case' 0 N--CA 1.497 1.9 0 C-N-CA 124.231 1.013 . . . . 72.450000000000003 112.594 -176.699 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -102.54 -174.67 2.62 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.369 1.067 . . . . 72.439999999999998 111.132 179.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -107.71 140.66 21.79 Favored Pre-proline 0 N--CA 1.486 1.353 0 C-N-CA 123.656 0.782 . . . . 74.200000000000003 109.402 175.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -56.43 -34.58 94.91 Favored 'Trans proline' 0 C--N 1.387 2.569 0 C-N-CA 123.105 2.536 . . . . 54.229999999999997 113.644 -172.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -60.35 -48.05 83.42 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.183 0.993 . . . . 73.519999999999996 111.024 175.12 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 24.7 mm-40 -72.97 -30.24 63.67 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.687 0.795 . . . . 64.420000000000002 111.681 -177.041 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 71.4 t -65.52 -44.03 94.14 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 123.292 0.637 . . . . 75.040000000000006 110.55 173.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 44.1 t -64.57 -42.97 95.29 Favored 'General case' 0 N--CA 1.485 1.302 0 CA-C-N 115.952 -0.567 . . . . 75.439999999999998 111.265 177.123 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 51.9 mt-10 -60.73 -44.47 96.6 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 123.576 0.751 . . . . 72.430000000000007 111.944 175.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 16.3 tpt180 -68.57 -39.15 81.12 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 122.642 0.377 . . . . 72.299999999999997 111.201 179.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -58.44 -53.03 62.97 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 124.063 0.945 . . . . 73.349999999999994 111.631 179.111 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.461 ' O ' ' HG2' ' A' ' 62' ' ' LYS . 66.6 mt-30 -73.04 -26.7 61.39 Favored 'General case' 0 CA--C 1.547 0.844 0 CA-C-N 115.324 -0.853 . . . . 71.109999999999999 111.226 -176.243 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 12.3 tm0? -69.7 -41.59 75.18 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 123.6 0.76 . . . . 72.209999999999994 109.366 173.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.418 HD22 HD11 ' A' ' 26' ' ' LEU . 13.0 mt -56.15 -48.13 76.87 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 124.355 1.062 . . . . 73.530000000000001 110.895 172.556 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 29.2 mmt -55.3 -46.35 76.24 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.235 0.614 . . . . 72.150000000000006 111.22 176.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' A' ' 58' ' ' GLN . 34.8 mmtp -58.55 -39.38 80.05 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 123.524 0.73 . . . . 73.019999999999996 112.316 177.155 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.582 ' HB3' ' HG3' ' A' ' 8' ' ' LYS . 97.6 mt -61.14 -52.83 63.21 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.142 0.577 . . . . 71.310000000000002 111.047 176.419 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -62.79 -29.66 70.87 Favored 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 123.047 0.539 . . . . 65.430000000000007 112.403 -179.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -68.91 -59.22 3.21 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 122.972 0.509 . . . . 72.409999999999997 110.924 174.498 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.622 ' HG2' ' H ' ' A' ' 68' ' ' LYS . 39.9 ttmt -175.62 140.16 0.45 Allowed 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.442 0.697 . . . . 64.5 110.853 -179.307 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 81.7 p -70.93 -26.27 63.12 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.609 0.764 . . . . 62.420000000000002 112.048 176.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.622 ' H ' ' HG2' ' A' ' 66' ' ' LYS . 67.3 mttm 66.48 -177.24 0.19 Allowed 'General case' 0 N--CA 1.496 1.865 0 C-N-CA 124.869 1.268 . . . . 74.030000000000001 111.949 -178.187 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 46.4 t 61.64 20.1 11.02 Favored 'General case' 0 N--CA 1.496 1.861 0 C-N-CA 124.163 0.985 . . . . 73.219999999999999 113.571 171.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 41.4 ttt-85 . . . . . 0 CA--C 1.565 1.549 0 C-N-CA 123.336 0.654 . . . . 74.340000000000003 111.52 -174.522 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 76.4 p . . . . . 0 N--CA 1.498 1.925 0 N-CA-C 111.182 0.067 . . . . 42.210000000000001 111.182 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 38.0 m80 -63.76 -59.69 4.24 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.191 0.597 . . . . 71.329999999999998 111.127 176.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 53.5 mtm 61.56 -176.21 0.12 Allowed 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 124.282 1.033 . . . . 73.530000000000001 112.836 177.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -158.73 88.59 0.92 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 123.42 0.688 . . . . 71.319999999999993 109.213 174.28 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -120.4 18.74 12.13 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-O 122.151 0.977 . . . . 70.140000000000001 109.638 -179.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 33.5 m -93.51 20.98 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.44 0 C-N-CA 124.322 1.049 . . . . 61.130000000000003 112.11 -175.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 2.0 mp -74.21 92.4 0.68 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.2 0 C-N-CA 123.448 0.699 . . . . 71.150000000000006 110.765 -172.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -170.32 163.4 8.74 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 124.849 1.26 . . . . 62.310000000000002 110.696 177.361 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 6.4 tmtt? -139.22 64.97 1.45 Allowed 'General case' 0 N--CA 1.487 1.392 0 N-CA-C 109.086 -0.709 . . . . 74.420000000000002 109.086 176.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -176.1 149.11 0.86 Allowed 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 124.25 1.02 . . . . 73.439999999999998 109.83 178.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 78.94 91.86 0.36 Allowed Glycine 0 C--N 1.346 1.118 0 N-CA-C 112.466 -0.254 . . . . 52.219999999999999 112.466 -178.117 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -77.81 12.04 1.89 Allowed 'General case' 0 CA--C 1.561 1.383 0 C-N-CA 124.108 0.963 . . . . 65.420000000000002 113.147 -171.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.413 HD12 ' H ' ' A' ' 13' ' ' ILE . 3.4 mp -69.08 122.73 21.08 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 C-N-CA 123.412 0.685 . . . . 42.119999999999997 109.586 175.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 30.6 pt -76.76 -8.71 11.94 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 N-CA-C 113.759 1.022 . . . . 64.450000000000003 113.759 -170.686 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 65.9 mt -98.93 118.12 45.03 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 C-N-CA 123.329 0.652 . . . . 75.230000000000004 110.463 179.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 55.8 tp -83.09 115.94 22.1 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.393 0.677 . . . . 63.409999999999997 111.038 178.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . 0.686 ' HZ2' ' HB3' ' A' ' 52' ' ' GLN . 81.6 m95 -104.18 112.32 25.29 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.891 0.876 . . . . 74.409999999999997 109.89 172.182 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 43.9 p -96.67 161.52 13.84 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 122.814 0.446 . . . . 51.130000000000003 110.834 -178.177 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 35.0 ptt180 -57.65 -23.26 50.33 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 123.527 0.731 . . . . 74.450000000000003 111.904 171.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 16.4 m120 -69.69 -46.24 66.47 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 123.905 0.882 . . . . 75.439999999999998 110.73 175.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 36.4 m-20 -58.61 -47.09 85.52 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.017 0.527 . . . . 53.130000000000003 111.234 174.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.448 ' HB3' HD21 ' A' ' 60' ' ' LEU . 56.5 m-20 -55.94 -47.16 78.07 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.157 0.983 . . . . 75.25 112.254 176.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 32.3 ttm180 -61.57 -40.22 93.98 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.915 0.486 . . . . 72.510000000000005 112.016 179.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 85.4 t -69.27 -40.0 79.75 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 122.73 0.412 . . . . 72.450000000000003 111.643 178.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 81.3 mt -58.88 -43.58 88.75 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 CA-C-O 120.877 0.37 . . . . 54.229999999999997 110.991 175.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 88.5 mt -70.94 -35.04 72.04 Favored 'General case' 0 CA--C 1.555 1.149 0 C-N-CA 123.287 0.635 . . . . 73.530000000000001 111.694 176.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 31.0 tp -67.27 -52.0 46.11 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 123.862 0.865 . . . . 71.340000000000003 111.719 -176.293 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -74.42 -20.49 60.03 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.123 0.569 . . . . 65.150000000000006 111.684 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 53.4 t -72.08 -34.7 68.89 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 122.85 0.46 . . . . 72.230000000000004 111.174 171.2 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -79.74 -15.61 57.18 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.158 0.583 . . . . 72.530000000000001 111.423 172.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 56.2 tptt -80.78 -48.38 12.56 Favored 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 123.694 0.798 . . . . 64.319999999999993 110.94 175.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 50.6 mtt180 -106.46 -63.58 1.26 Allowed 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.737 0.815 . . . . 75.430000000000007 111.447 -178.537 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 136.7 154.1 6.66 Favored Glycine 0 CA--C 1.539 1.544 0 CA-C-O 119.086 -0.841 . . . . 71.120000000000005 111.694 -172.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_exo -57.68 109.08 0.43 Allowed 'Trans proline' 0 C--N 1.374 1.88 0 C-N-CA 123.128 2.552 . . . . 44.310000000000002 113.168 176.319 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 46.7 t -156.39 155.37 32.03 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.316 0.646 . . . . 71.430000000000007 111.371 -177.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 58.4 p -62.91 -33.47 75.4 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.547 0.739 . . . . 73.310000000000002 111.23 172.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -63.96 -33.85 76.65 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.516 0.726 . . . . 73.349999999999994 111.124 173.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 38.4 m -83.36 -27.98 29.29 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 123.276 0.63 . . . . 55.420000000000002 110.192 -176.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 22.5 m-30 -69.35 -36.29 76.73 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.242 0.617 . . . . 63.340000000000003 110.849 172.483 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.02 -39.84 87.12 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 123.451 0.7 . . . . 73.200000000000003 110.924 173.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 43.6 t80 -65.54 -39.52 91.84 Favored 'General case' 0 CA--C 1.557 1.242 0 C-N-CA 124.425 1.09 . . . . 73.120000000000005 111.876 176.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.465 ' HB2' HG11 ' A' ' 53' ' ' VAL . 39.5 mt -73.41 -29.28 62.49 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 124.168 0.987 . . . . 72.140000000000001 112.248 175.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.47 -39.18 93.77 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 122.867 0.467 . . . . 55.25 110.385 171.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -71.36 -43.27 67.24 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 123.52 0.728 . . . . 43.329999999999998 112.001 175.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -70.05 -39.91 75.41 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.937 0.895 . . . . 71.140000000000001 112.09 -172.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 91.9 mt -100.26 -3.48 31.33 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 123.601 0.761 . . . . 75.430000000000007 112.962 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 60.15 25.01 14.32 Favored 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 124.246 1.018 . . . . 72.439999999999998 112.311 -177.192 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 48.6 mmtm -94.43 171.9 8.53 Favored 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 124.197 0.999 . . . . 71.150000000000006 110.291 177.324 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 37.4 m-80 -75.62 145.05 78.17 Favored Pre-proline 0 N--CA 1.486 1.333 0 CA-C-O 118.944 -0.55 . . . . 64.310000000000002 110.127 174.359 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -60.42 -28.83 87.49 Favored 'Trans proline' 0 C--N 1.381 2.252 0 C-N-CA 122.443 2.096 . . . . 73.319999999999993 112.503 178.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -72.27 -39.53 68.3 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.283 1.033 . . . . 71.349999999999994 110.629 177.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.686 ' HB3' ' HZ2' ' A' ' 17' ' ' TRP . 24.3 mm-40 -63.73 -38.27 90.49 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.603 0.761 . . . . 73.150000000000006 111.906 173.419 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.465 HG11 ' HB2' ' A' ' 42' ' ' LEU . 69.6 t -69.64 -48.88 63.0 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.967 0 C-N-CA 123.268 0.627 . . . . 73.109999999999999 111.877 179.932 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 79.9 p -58.04 -42.72 86.0 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 123.117 0.567 . . . . 71.319999999999993 111.48 179.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -61.83 -52.58 63.58 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.989 0.516 . . . . 71.109999999999999 112.203 173.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 28.4 tpt180 -65.25 -31.3 72.39 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 122.896 0.479 . . . . 73.430000000000007 112.108 -174.576 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -57.27 -52.28 65.95 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.869 0.868 . . . . 73.019999999999996 110.847 171.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 42.2 mt-30 -73.77 -23.36 59.71 Favored 'General case' 0 CA--C 1.552 1.035 0 CA-C-N 115.472 -0.786 . . . . 64.040000000000006 112.219 -176.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.451 ' O ' ' HG ' ' A' ' 63' ' ' LEU . 36.1 mm-40 -65.86 -46.94 76.6 Favored 'General case' 0 N--CA 1.484 1.259 0 N-CA-C 109.469 -0.567 . . . . 43.439999999999998 109.469 168.779 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.448 HD21 ' HB3' ' A' ' 22' ' ' ASP . 21.6 mt -58.62 -45.22 89.68 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.298 1.039 . . . . 70.5 112.304 175.77 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 36.0 mmt -59.96 -36.18 76.54 Favored 'General case' 0 N--CA 1.491 1.616 0 CA-C-O 121.261 0.553 . . . . 74.209999999999994 111.295 177.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 17.3 tptp -68.96 -32.13 71.49 Favored 'General case' 0 CA--C 1.561 1.369 0 C-N-CA 123.858 0.863 . . . . 74.140000000000001 110.919 177.32 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.451 ' HG ' ' O ' ' A' ' 59' ' ' GLN . 70.9 mt -75.87 -30.59 58.93 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.767 0.827 . . . . 73.120000000000005 111.884 177.722 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -62.62 -29.03 70.31 Favored 'General case' 0 N--CA 1.495 1.792 0 C-N-CA 122.875 0.47 . . . . 64.420000000000002 111.67 172.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -65.71 -59.36 3.99 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.01 0.524 . . . . 75.219999999999999 109.819 170.161 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -172.28 125.54 0.52 Allowed 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.027 0.931 . . . . 73.209999999999994 109.987 179.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 64.0 m -83.23 85.75 7.15 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-O 121.381 0.61 . . . . 52.25 109.998 175.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 45.0 tttm -96.33 137.11 35.89 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.612 1.165 . . . . 72.420000000000002 110.474 179.119 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 51.0 t 66.11 -66.93 0.16 Allowed 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 125.134 1.374 . . . . 71.310000000000002 111.2 -169.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 29.8 mmm180 . . . . . 0 CA--C 1.563 1.469 0 C-N-CA 123.464 0.705 . . . . 70.230000000000004 109.981 173.121 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 64.8 p . . . . . 0 N--CA 1.488 1.465 0 CA-C-O 120.569 0.223 . . . . 72.530000000000001 110.765 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 84.2 m-70 -139.23 -57.42 0.6 Allowed 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 124.007 0.923 . . . . 72.409999999999997 110.414 175.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . 0.507 ' HG2' ' H ' ' A' ' 4' ' ' LYS . 31.2 ttm 60.23 -174.44 0.11 Allowed 'General case' 0 CA--C 1.572 1.797 0 C-N-CA 124.385 1.074 . . . . 75.540000000000006 110.638 -174.335 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.507 ' H ' ' HG2' ' A' ' 3' ' ' MET . 4.6 ttmp? 69.63 -1.17 2.36 Favored 'General case' 0 N--CA 1.503 2.181 0 N-CA-C 113.605 0.965 . . . . 72.319999999999993 113.605 167.677 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -77.86 174.74 10.7 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.63 0.772 . . . . 73.329999999999998 111.93 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 40.5 t 61.92 75.44 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 C-N-CA 124.48 1.112 . . . . 64.439999999999998 109.549 -168.286 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.0 mp -77.96 102.11 4.1 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.923 0 CA-C-N 115.12 -0.945 . . . . 70.200000000000003 109.611 -173.591 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -123.65 138.48 54.53 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.632 0.773 . . . . 41.210000000000001 110.314 177.625 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 44.6 pttt -151.76 159.03 44.09 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 124.635 1.174 . . . . 61.009999999999998 109.771 -176.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 48.6 mtmt 65.76 -170.32 0.2 Allowed 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 124.748 1.219 . . . . 64.200000000000003 111.819 -170.204 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 123.12 169.58 13.31 Favored Glycine 0 N--CA 1.475 1.269 0 CA-C-N 116.425 -0.352 . . . . 51.229999999999997 112.849 177.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.475 ' HG3' ' HG3' ' A' ' 70' ' ' ARG . 34.6 mm-40 -87.67 96.91 10.6 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 123.059 0.544 . . . . 74.140000000000001 112.083 -178.464 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.3 mp -118.28 122.36 69.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 N-CA-C 108.496 -0.927 . . . . 71.340000000000003 108.496 169.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 37.8 pt -81.0 -22.63 10.85 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 C-N-CA 122.964 0.506 . . . . 63.210000000000001 112.09 179.194 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 29.1 mt -95.2 156.69 3.17 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.353 0 C-N-CA 124.378 1.071 . . . . 65.450000000000003 109.661 177.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 33.8 tp -78.41 91.16 4.46 Favored 'General case' 0 CA--C 1.562 1.43 0 O-C-N 121.692 -0.63 . . . . 62.219999999999999 110.705 175.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 89.6 m95 -117.84 146.33 43.95 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 124.732 1.213 . . . . 71.329999999999998 110.061 175.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 15.8 p -101.59 165.78 11.05 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 109.902 -0.407 . . . . 71.540000000000006 109.902 173.068 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 20.2 ptp180 -66.55 -21.37 66.15 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 123.211 0.604 . . . . 75.219999999999999 111.281 177.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.415 ' O ' HG23 ' A' ' 24' ' ' VAL . 5.8 m120 -75.58 -50.67 14.87 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.167 0.987 . . . . 63.539999999999999 110.097 179.81 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 52.7 m-20 -63.59 -42.31 98.28 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.132 0.573 . . . . 74.040000000000006 110.606 177.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -53.87 -50.42 66.31 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 125.034 1.334 . . . . 63.009999999999998 111.281 176.115 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.6 -29.14 65.47 Favored 'General case' 0 CA--C 1.558 1.257 0 CA-C-N 115.305 -0.861 . . . . 65.319999999999993 112.014 -178.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.415 HG23 ' O ' ' A' ' 20' ' ' ASN . 53.7 t -68.93 -40.88 81.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.386 0 C-N-CA 122.717 0.407 . . . . 54.420000000000002 110.952 173.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 86.8 mt -56.99 -59.42 3.13 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.364 0 O-C-N 123.306 0.378 . . . . 73.019999999999996 110.288 175.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.545 HD11 HD22 ' A' ' 60' ' ' LEU . 83.9 mt -59.8 -34.1 72.59 Favored 'General case' 0 N--CA 1.485 1.302 0 N-CA-C 112.833 0.679 . . . . 61.229999999999997 112.833 -176.486 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 37.6 tp -75.93 -57.0 4.13 Favored 'General case' 0 CA--C 1.554 1.104 0 C-N-CA 123.135 0.574 . . . . 74.099999999999994 112.255 -175.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.749 ' HB2' HD21 ' A' ' 42' ' ' LEU . 24.5 mt-10 -77.75 -18.81 56.1 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 112.893 0.701 . . . . 74.219999999999999 112.893 -176.49 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.479 ' SG ' ' HA ' ' A' ' 34' ' ' PRO . 43.1 t -70.9 -51.01 28.8 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.635 0.374 . . . . 63.109999999999999 110.922 176.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 13.7 pt20 -66.87 -27.91 67.91 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 122.863 0.465 . . . . 71.519999999999996 111.61 174.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 59.9 tptt -65.05 -50.08 67.61 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.814 0.845 . . . . 53.229999999999997 111.057 176.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 61.3 mtp85 -100.6 11.67 39.0 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 112.766 0.654 . . . . 71.129999999999995 112.766 -175.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 79.51 110.8 0.24 Allowed Glycine 0 CA--C 1.544 1.892 0 CA-C-O 118.762 -1.021 . . . . 61.229999999999997 112.377 178.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.479 ' HA ' ' SG ' ' A' ' 29' ' ' CYS . 20.1 Cg_endo -57.53 99.34 0.09 OUTLIER 'Trans proline' 0 C--N 1.382 2.32 0 C-N-CA 123.373 2.716 . . . . 52.240000000000002 113.691 -173.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 23.0 t -157.37 174.22 15.74 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 123.224 0.609 . . . . 74.230000000000004 112.004 -172.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 60.5 p -55.5 -50.33 70.22 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 124.78 1.232 . . . . 73.140000000000001 113.689 -175.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 26.5 mtpp -69.22 -15.13 63.31 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 112.9 0.704 . . . . 54.329999999999998 112.9 -178.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.404 HG21 ' HA ' ' A' ' 29' ' ' CYS . 27.5 m -87.31 -34.06 19.0 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.469 0.708 . . . . 60.340000000000003 109.693 177.124 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 22.7 m-85 -66.67 -35.67 80.7 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 123.212 0.605 . . . . 73.200000000000003 110.847 173.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.41 -36.55 83.11 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.455 0.702 . . . . 55.520000000000003 111.775 175.226 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -63.24 -55.66 23.05 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.376 0.67 . . . . 71.230000000000004 111.216 172.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.749 HD21 ' HB2' ' A' ' 28' ' ' GLU . 81.2 mt -62.17 -23.25 66.48 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 124.177 0.991 . . . . 75.049999999999997 112.616 178.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.3 -57.7 8.63 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.347 0.659 . . . . 70.430000000000007 111.32 173.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.9 -30.67 71.3 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-N 115.876 -0.602 . . . . 62.109999999999999 111.666 178.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.405 ' HE2' ' HA ' ' A' ' 45' ' ' LYS . 0.5 OUTLIER -68.28 -42.87 78.89 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 123.703 0.801 . . . . 75.239999999999995 111.78 177.801 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 89.8 mt -104.25 12.85 33.2 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 123.485 0.714 . . . . 74.219999999999999 112.831 -175.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.2 t70 64.18 16.09 9.8 Favored 'General case' 0 CA--C 1.575 1.911 0 C-N-CA 124.064 0.946 . . . . 74.319999999999993 112.558 175.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -107.83 -175.11 2.69 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.777 0.831 . . . . 74.450000000000003 112.008 -178.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -91.65 150.98 41.93 Favored Pre-proline 0 N--CA 1.484 1.236 0 C-N-CA 123.302 0.641 . . . . 73.209999999999994 110.145 176.608 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 79.1 Cg_exo -52.59 -35.41 67.18 Favored 'Trans proline' 0 C--N 1.384 2.402 0 C-N-CA 122.857 2.371 . . . . 54.350000000000001 113.618 174.781 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -64.46 -46.9 81.13 Favored 'General case' 0 CA--C 1.557 1.248 0 C-N-CA 123.172 0.589 . . . . 73.310000000000002 110.43 176.379 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 81.5 mm-40 -54.78 -46.84 74.47 Favored 'General case' 0 N--CA 1.499 1.977 0 C-N-CA 123.743 0.817 . . . . 73.219999999999999 112.008 179.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.536 HG11 ' HB2' ' A' ' 42' ' ' LEU . 69.4 t -65.7 -45.41 92.06 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 CA-C-N 115.286 -0.87 . . . . 65.319999999999993 111.183 179.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . 0.445 ' O ' ' HG3' ' A' ' 58' ' ' GLN . 35.0 t -58.09 -43.39 87.06 Favored 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 123.344 0.658 . . . . 71.310000000000002 111.6 177.286 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -62.09 -53.91 48.71 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.511 0.725 . . . . 72.140000000000001 111.64 178.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.409 ' HA ' ' HD2' ' A' ' 56' ' ' ARG . 10.7 tpt180 -61.59 -38.49 87.76 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 122.683 0.393 . . . . 75.420000000000002 111.621 -178.704 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -55.46 -52.62 63.02 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.853 0.861 . . . . 74.430000000000007 112.134 174.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.445 ' HG3' ' O ' ' A' ' 54' ' ' SER . 83.3 mt-30 -73.59 -24.39 60.06 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.326 0.65 . . . . 75.5 112.136 -175.493 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.459 ' O ' ' HG ' ' A' ' 63' ' ' LEU . 19.1 mm-40 -68.3 -43.61 77.29 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 122.998 0.519 . . . . 63.229999999999997 109.641 170.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.545 HD22 HD11 ' A' ' 26' ' ' LEU . 14.3 mt -60.59 -45.55 93.53 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.285 1.034 . . . . 51.229999999999997 112.262 176.057 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 35.1 mmt -57.81 -43.73 85.87 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.364 0.666 . . . . 64.409999999999997 110.768 175.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.49 ' HE3' ' HA ' ' A' ' 62' ' ' LYS . 0.2 OUTLIER -64.88 -31.58 72.87 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 123.893 0.877 . . . . 60.340000000000003 111.841 178.222 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' A' ' 59' ' ' GLN . 97.6 mt -72.93 -35.9 67.12 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 123.295 0.638 . . . . 75.109999999999999 111.717 175.734 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 47.4 m-85 -65.29 -27.56 68.71 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-O 120.865 0.364 . . . . 72.310000000000002 111.232 173.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -80.18 -41.55 25.07 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.643 0.777 . . . . 52.200000000000003 111.396 173.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 26.4 ttpp -165.13 110.61 0.92 Allowed 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 124.121 0.968 . . . . 60.509999999999998 110.956 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 16.4 t -123.48 24.72 8.52 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 123.95 0.9 . . . . 70.340000000000003 111.21 178.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -58.61 -42.8 89.0 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 123.079 0.552 . . . . 63.140000000000001 111.523 177.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.447 ' SG ' ' HD2' ' A' ' 70' ' ' ARG . 42.6 t -149.59 -78.4 0.14 Allowed 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.688 0.795 . . . . 62.32 109.09 175.074 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.475 ' HG3' ' HG3' ' A' ' 12' ' ' GLU . 4.6 mpt_? . . . . . 0 C--O 1.26 1.609 0 N-CA-C 108.502 -0.925 . . . . 64.420000000000002 108.502 165.009 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 64.0 p . . . . . 0 N--CA 1.489 1.482 0 CA-C-O 120.769 0.318 . . . . 55.030000000000001 111.145 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -107.79 -25.64 11.16 Favored 'General case' 0 CA--C 1.56 1.33 0 C-N-CA 124.017 0.927 . . . . 74.340000000000003 110.079 175.826 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 24.5 ptp -63.13 160.22 15.83 Favored 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 124.003 0.921 . . . . 61.210000000000001 112.985 -179.761 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -156.35 -174.38 4.92 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 123.479 0.712 . . . . 64.510000000000005 110.611 -179.074 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 6.2 p30 -116.59 139.61 50.31 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 123.826 0.85 . . . . 74.109999999999999 109.645 165.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.6 p -94.14 -32.15 4.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 C-N-CA 122.888 0.475 . . . . 62.100000000000001 111.589 179.182 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 44.2 mm 59.07 92.89 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.326 0 C-N-CA 125.163 1.385 . . . . 65.340000000000003 112.649 -178.485 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 59.8 mttp -123.78 113.65 18.85 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.577 0.751 . . . . 64.439999999999998 109.532 168.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -149.03 161.13 42.55 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.372 0.669 . . . . 72.040000000000006 110.565 176.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 45.2 tptt 61.95 30.07 17.96 Favored 'General case' 0 CA--C 1.566 1.582 0 C-N-CA 124.2 1.0 . . . . 73.140000000000001 111.704 178.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -78.13 61.49 3.79 Favored Glycine 0 C--N 1.354 1.57 0 CA-C-N 115.926 -0.579 . . . . 74.329999999999998 111.893 172.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -90.21 17.11 7.44 Favored 'General case' 0 CA--C 1.564 1.513 0 C-N-CA 124.805 1.242 . . . . 75.409999999999997 111.606 -169.702 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.9 pp -64.51 145.65 13.72 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.261 0 C-N-CA 123.752 0.821 . . . . 73.120000000000005 112.242 175.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 16.4 tt -74.07 -16.89 16.95 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 C-N-CA 123.835 0.854 . . . . 62.439999999999998 112.286 -176.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 19.2 mt -76.96 143.01 13.51 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.062 0 C-N-CA 124.027 0.931 . . . . 70.530000000000001 110.839 -177.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.7 tt -75.54 115.33 15.09 Favored 'General case' 0 CA--C 1.558 1.282 0 C-N-CA 123.414 0.686 . . . . 74.430000000000007 109.792 178.141 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . 0.583 ' HZ3' HD13 ' A' ' 46' ' ' LEU . 98.6 m95 -140.56 145.68 37.07 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 124.657 1.183 . . . . 75.329999999999998 110.414 176.213 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 18.0 p -122.2 158.16 30.02 Favored 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 109.259 -0.645 . . . . 71.120000000000005 109.259 170.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.6 ptp180 -63.24 -19.04 64.19 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 123.562 0.745 . . . . 72.019999999999996 112.673 176.541 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.471 ' O ' HG23 ' A' ' 24' ' ' VAL . 25.5 m-80 -68.55 -46.71 68.75 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.124 0.57 . . . . 74.239999999999995 109.755 170.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 66.2 m-20 -62.92 -43.57 98.42 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 123.589 0.756 . . . . 74.5 111.24 176.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.674 ' HB3' HD21 ' A' ' 60' ' ' LEU . 68.7 m-20 -56.51 -42.68 78.8 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.742 1.217 . . . . 64.219999999999999 111.768 175.69 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 32.5 ttm180 -61.37 -45.68 93.35 Favored 'General case' 0 N--CA 1.483 1.186 0 CA-C-N 115.48 -0.782 . . . . 63.210000000000001 110.917 175.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.471 HG23 ' O ' ' A' ' 20' ' ' ASN . 78.2 t -62.34 -41.69 92.6 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 C-N-CA 123.988 0.915 . . . . 72.430000000000007 112.207 -177.835 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 88.6 mt -61.2 -52.86 56.5 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 C-N-CA 122.327 0.251 . . . . 72.420000000000002 110.803 177.429 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.491 ' HG ' HD13 ' A' ' 60' ' ' LEU . 94.1 mt -58.65 -37.08 75.19 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 123.489 0.716 . . . . 74.329999999999998 112.18 176.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 28.3 tp -74.82 -50.55 16.78 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.61 0.764 . . . . 61.32 111.706 -174.351 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -74.64 -18.74 60.5 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 123.171 0.588 . . . . 54.109999999999999 112.162 -177.519 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 87.2 m -66.17 -30.14 70.56 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 122.628 0.371 . . . . 52.549999999999997 111.092 166.366 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . 0.402 ' HG2' ' O ' ' A' ' 26' ' ' LEU . 12.6 mm100 -81.91 -24.49 35.64 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.995 0.518 . . . . 72.420000000000002 111.868 174.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 2.1 mptm? -71.83 -73.23 0.19 Allowed 'General case' 0 N--CA 1.494 1.732 0 CA-C-O 121.27 0.557 . . . . 63.530000000000001 110.739 169.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.568 HH21 ' HG2' ' A' ' 37' ' ' LYS . 18.2 mtp180 -84.41 -53.99 5.07 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 123.941 0.896 . . . . 74.319999999999993 112.032 -171.238 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 131.25 163.35 10.87 Favored Glycine 0 N--CA 1.482 1.763 0 CA-C-O 119.525 -0.597 . . . . 73.040000000000006 113.076 -179.476 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_exo -67.52 85.7 0.36 Allowed 'Trans proline' 0 C--N 1.379 2.142 0 C-N-CA 122.888 2.392 . . . . 50.329999999999998 111.905 173.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 49.2 m -141.72 148.55 39.21 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 124.108 0.963 . . . . 54.130000000000003 110.051 -176.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 89.9 p -61.76 -31.97 72.2 Favored 'General case' 0 N--CA 1.498 1.945 0 C-N-CA 123.281 0.632 . . . . 64.099999999999994 111.478 176.74 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.568 ' HG2' HH21 ' A' ' 32' ' ' ARG . 88.3 tttt -59.17 -34.45 72.13 Favored 'General case' 0 CA--C 1.561 1.397 0 C-N-CA 125.074 1.349 . . . . 71.319999999999993 111.751 173.229 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 87.5 m -79.11 -39.33 33.96 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 124.094 0.958 . . . . 72.329999999999998 110.18 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 26.7 m-85 -65.86 -26.89 67.85 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-N 115.179 -0.919 . . . . 72.109999999999999 111.95 175.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.31 -36.88 84.07 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.338 0.655 . . . . 70.200000000000003 111.668 173.206 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -66.44 -54.51 23.31 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 123.116 0.566 . . . . 74.010000000000005 110.642 172.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 96.1 mt -60.7 -23.06 64.58 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.459 1.104 . . . . 71.319999999999993 112.41 178.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.65 -57.5 9.86 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.231 0.612 . . . . 72.5 111.467 174.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -68.52 -27.58 66.24 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-N 115.544 -0.753 . . . . 75.230000000000004 112.161 179.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.451 ' HD3' HD23 ' A' ' 46' ' ' LEU . 0.6 OUTLIER -70.64 -58.18 3.94 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.731 0.813 . . . . 71.450000000000003 109.711 179.608 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.583 HD13 ' HZ3' ' A' ' 17' ' ' TRP . 41.4 mt -83.23 -5.35 59.1 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.475 0.71 . . . . 72.439999999999998 112.614 -173.402 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.1 t70 72.73 -2.71 2.58 Favored 'General case' 0 N--CA 1.498 1.935 0 C-N-CA 125.006 1.322 . . . . 64.140000000000001 112.146 -177.129 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.469 ' HA ' ' HE2' ' A' ' 48' ' ' LYS . 11.5 mmpt? -97.55 137.58 36.27 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.772 0.829 . . . . 70.030000000000001 110.058 -177.142 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 36.0 m-80 -52.19 149.44 9.77 Favored Pre-proline 0 N--CA 1.494 1.767 0 C-N-CA 123.49 0.716 . . . . 72.299999999999997 112.645 178.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_endo -59.32 -22.12 63.87 Favored 'Trans proline' 0 C--N 1.387 2.601 0 C-N-CA 122.828 2.352 . . . . 52.020000000000003 113.082 -176.06 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -68.22 -43.76 77.28 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 124.022 0.929 . . . . 75.340000000000003 110.896 172.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 11.4 mm-40 -65.73 -41.88 91.7 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.393 0.677 . . . . 72.129999999999995 111.076 178.263 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 99.2 t -69.36 -43.83 80.73 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 C-N-CA 123.573 0.749 . . . . 64.239999999999995 111.807 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 93.5 p -62.67 -39.48 94.06 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.097 0.559 . . . . 74.400000000000006 111.029 179.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -72.5 -36.69 68.46 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 115.824 -0.625 . . . . 70.230000000000004 112.01 175.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -67.63 -34.97 78.05 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 122.775 0.43 . . . . 74.530000000000001 111.398 -179.195 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 8.2 t80 -53.63 -45.49 70.17 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.808 0.843 . . . . 75.209999999999994 110.242 169.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.524 ' O ' ' HG3' ' A' ' 62' ' ' LYS . 40.4 mt-30 -74.48 -30.33 61.8 Favored 'General case' 0 CA--C 1.548 0.879 0 CA-C-N 114.984 -1.007 . . . . 74.230000000000004 112.052 178.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 75.5 mt-30 -68.46 -38.62 81.25 Favored 'General case' 0 N--CA 1.497 1.885 0 C-N-CA 123.908 0.883 . . . . 72.099999999999994 110.788 178.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.674 HD21 ' HB3' ' A' ' 22' ' ' ASP . 32.7 mt -53.62 -51.77 62.0 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.281 1.032 . . . . 62.5 110.245 168.44 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 45.5 mtt -68.88 -25.35 64.57 Favored 'General case' 0 CA--C 1.552 1.041 0 N-CA-C 113.335 0.865 . . . . 72.120000000000005 113.335 178.406 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.524 ' HG3' ' O ' ' A' ' 58' ' ' GLN . 60.8 mttp -63.7 -40.8 97.67 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-N 118.368 0.531 . . . . 70.319999999999993 110.048 173.356 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 75.2 mt -75.59 -41.6 54.13 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.52 0.728 . . . . 73.319999999999993 111.574 177.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 22.8 m-30 -65.2 -28.5 69.43 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.074 0.55 . . . . 75.340000000000003 111.598 177.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -71.61 -64.07 1.0 Allowed 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 108.698 -0.852 . . . . 73.439999999999998 108.698 172.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . 0.488 ' HD3' ' HA ' ' A' ' 66' ' ' LYS . 44.7 mmtt -164.03 -72.54 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 125.612 1.565 . . . . 73.140000000000001 109.217 174.667 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 45.8 t -176.93 139.15 0.27 Allowed 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 124.454 1.102 . . . . 54.409999999999997 109.746 178.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -158.5 116.54 2.95 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 123.338 0.655 . . . . 74.530000000000001 110.286 177.062 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 60.9 m -79.83 -13.79 59.15 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.339 0.656 . . . . 55.409999999999997 112.658 -178.416 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 3.7 tmt_? . . . . . 0 CA--C 1.57 1.718 0 C-N-CA 125.311 1.444 . . . . 64.340000000000003 110.503 -179.639 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 80.9 p . . . . . 0 N--CA 1.494 1.77 0 CA-C-O 120.355 0.122 . . . . 71.299999999999997 110.888 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 77.5 m80 -138.21 120.31 15.63 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 124.014 0.925 . . . . 74.230000000000004 109.818 178.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 53.9 ttm -70.5 101.1 1.92 Allowed 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 123.586 0.754 . . . . 65.120000000000005 111.092 -178.722 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -115.59 -60.77 1.83 Allowed 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.52 0.728 . . . . 74.129999999999995 110.804 -179.595 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -75.43 81.2 2.48 Favored 'General case' 0 N--CA 1.481 1.114 0 CA-C-O 121.388 0.613 . . . . 71.329999999999998 109.846 177.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 7.5 p -135.34 137.67 49.63 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.814 0 C-N-CA 124.136 0.975 . . . . 73.019999999999996 110.275 -178.214 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.1 mp -88.39 107.59 17.79 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.917 0 N-CA-C 109.257 -0.645 . . . . 71.319999999999993 109.257 178.29 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.4 mtpp -69.46 83.34 0.4 Allowed 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 108.856 -0.794 . . . . 73.310000000000002 108.856 166.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 7.6 tmtt? -69.71 -57.03 5.63 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 115.642 -0.708 . . . . 73.409999999999997 109.267 -175.564 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 47.8 mtpt -138.89 175.94 9.12 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-O 121.68 0.753 . . . . 73.420000000000002 111.858 177.343 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 175.63 142.62 4.25 Favored Glycine 0 C--N 1.343 0.924 0 CA-C-N 114.514 -1.221 . . . . 41.310000000000002 110.66 174.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -79.86 84.67 5.6 Favored 'General case' 0 CA--C 1.556 1.194 0 CA-C-N 117.597 0.699 . . . . 72.430000000000007 109.707 -179.337 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.528 HG23 HH21 ' A' ' 56' ' ' ARG . 4.6 mp -135.42 131.67 51.6 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 C-N-CA 123.858 0.863 . . . . 72.120000000000005 110.001 174.012 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.408 HG23 HG13 ' A' ' 15' ' ' ILE . 14.3 tt -99.26 -28.08 3.51 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.931 0 C-N-CA 123.756 0.822 . . . . 74.219999999999999 111.148 174.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.408 HG13 HG23 ' A' ' 14' ' ' ILE . 70.1 mt -83.17 159.1 3.72 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.564 0 C-N-CA 124.689 1.196 . . . . 63.43 111.008 -177.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 60.2 tp -67.01 89.14 0.16 Allowed 'General case' 0 CA--C 1.559 1.313 0 CA-C-O 121.364 0.602 . . . . 71.099999999999994 112.041 178.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . 0.506 ' HB2' HG21 ' A' ' 13' ' ' ILE . 95.9 m95 -128.98 124.92 36.28 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 123.847 0.859 . . . . 72.299999999999997 110.212 176.187 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 72.2 p -131.68 168.1 18.32 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.43 1.092 . . . . 72.109999999999999 110.521 -172.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -56.59 -22.9 36.97 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 123.68 0.792 . . . . 52.210000000000001 113.113 -178.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.448 ' O ' HG23 ' A' ' 24' ' ' VAL . 10.9 m-80 -71.36 -49.79 38.77 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.54 0.736 . . . . 64.129999999999995 110.268 179.615 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.406 ' HB3' HD13 ' A' ' 46' ' ' LEU . 0.4 OUTLIER -72.45 -41.76 65.74 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-N 115.675 -0.693 . . . . 74.019999999999996 110.101 -176.524 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.486 ' HB3' HD21 ' A' ' 60' ' ' LEU . 2.1 m-20 -51.31 -44.71 62.0 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 124.735 1.214 . . . . 74.540000000000006 111.805 172.253 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 60.6 ttp180 -60.61 -45.88 92.37 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.51 0.724 . . . . 74.239999999999995 111.554 175.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.448 HG23 ' O ' ' A' ' 20' ' ' ASN . 58.3 t -63.07 -37.0 78.21 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.353 0 C-N-CA 123.567 0.747 . . . . 74.510000000000005 111.378 -179.501 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 86.8 mt -64.13 -50.03 78.75 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 C-N-CA 122.813 0.445 . . . . 73.129999999999995 110.875 175.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 95.3 mt -59.36 -33.08 70.73 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 123.358 0.663 . . . . 63.340000000000003 111.946 176.519 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 45.8 tp -69.35 -58.13 4.4 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.41 0.684 . . . . 64.340000000000003 110.883 179.368 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.59 ' HA ' ' HB3' ' A' ' 31' ' ' LYS . 75.2 mm-40 -68.26 -23.19 64.75 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 123.576 0.75 . . . . 71.340000000000003 112.614 -177.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 54.1 t -68.17 -29.05 67.83 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.208 0.603 . . . . 60.020000000000003 111.98 174.246 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 97.7 mt-30 -104.02 -15.07 15.7 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 123.2 0.6 . . . . 62.329999999999998 112.023 176.488 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.59 ' HB3' ' HA ' ' A' ' 28' ' ' GLU . 43.7 tttm -82.65 -49.52 9.72 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 124.154 0.982 . . . . 64.450000000000003 110.805 177.025 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 88.4 mtt180 -99.17 -64.11 1.07 Allowed 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 123.676 0.79 . . . . 52.32 110.303 171.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 152.39 173.94 22.44 Favored Glycine 0 CA--C 1.539 1.548 0 CA-C-N 115.266 -0.879 . . . . 73.310000000000002 111.912 -172.699 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -86.02 31.46 0.47 Allowed 'Trans proline' 0 CA--C 1.56 1.814 0 C-N-CA 123.002 2.468 . . . . 64.109999999999999 113.879 -179.471 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 43.2 t -80.09 161.03 25.56 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 123.358 0.663 . . . . 74.329999999999998 112.611 -177.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 78.3 p -65.49 -28.19 69.02 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 124.099 0.96 . . . . 73.409999999999997 111.93 176.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -76.65 -18.97 58.28 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.405 0.682 . . . . 72.340000000000003 111.743 176.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 56.7 m -82.37 -38.4 24.21 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 109.203 -0.665 . . . . 62.340000000000003 109.203 171.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -64.76 -29.26 70.23 Favored 'General case' 0 CA--C 1.552 1.036 0 CA-C-N 115.658 -0.701 . . . . 73.340000000000003 110.977 173.058 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.419 ' HA ' ' HG3' ' A' ' 50' ' ' PRO . . . -70.97 -34.79 71.76 Favored 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 123.668 0.787 . . . . 72.099999999999994 111.548 173.708 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -63.5 -54.96 28.16 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 109.726 -0.472 . . . . 72.420000000000002 109.726 171.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.437 ' HA ' ' HB3' ' A' ' 45' ' ' LYS . 52.2 mt -59.78 -24.73 64.33 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 125.271 1.428 . . . . 54.140000000000001 112.972 179.074 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.37 -55.47 17.99 Favored 'General case' 0 CA--C 1.552 1.03 0 CA-C-O 121.045 0.45 . . . . 53.119999999999997 110.742 172.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -67.49 -28.43 67.84 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.537 0.735 . . . . 71.040000000000006 112.118 177.568 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.437 ' HB3' ' HA ' ' A' ' 42' ' ' LEU . 23.1 tptm -76.2 -38.43 56.53 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.569 1.148 . . . . 72.319999999999993 111.594 -176.09 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.406 HD13 ' HB3' ' A' ' 21' ' ' ASP . 62.6 mt -112.52 11.32 19.74 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.659 0.784 . . . . 51.340000000000003 112.443 -173.331 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 64.37 21.71 12.56 Favored 'General case' 0 N--CA 1.506 2.359 0 C-N-CA 124.762 1.225 . . . . 54.43 112.684 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 46.6 mmtm -109.94 -163.2 0.84 Allowed 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.725 0.81 . . . . 71.230000000000004 111.796 -175.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.493 ' HB2' HE21 ' A' ' 52' ' ' GLN . 26.1 m-80 -124.87 147.1 55.39 Favored Pre-proline 0 N--CA 1.487 1.385 0 C-N-CA 123.919 0.888 . . . . 75.209999999999994 109.984 178.882 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.419 ' HG3' ' HA ' ' A' ' 40' ' ' ALA . 50.6 Cg_exo -55.25 -27.99 59.72 Favored 'Trans proline' 0 C--N 1.382 2.32 0 C-N-CA 123.547 2.831 . . . . 55.140000000000001 115.659 -172.14 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -72.13 -44.81 62.55 Favored 'General case' 0 N--CA 1.494 1.768 0 C-N-CA 123.253 0.621 . . . . 64.209999999999994 111.117 176.015 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.493 HE21 ' HB2' ' A' ' 49' ' ' ASN . 43.4 mt-30 -57.46 -41.35 80.39 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 123.887 0.875 . . . . 72.209999999999994 111.993 172.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.413 HG11 ' HB2' ' A' ' 42' ' ' LEU . 66.8 t -69.78 -43.07 80.18 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.032 0 CA-C-N 115.76 -0.655 . . . . 74.450000000000003 111.291 177.722 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 45.2 t -60.01 -34.84 73.89 Favored 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 123.721 0.808 . . . . 73.239999999999995 111.658 177.332 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -67.19 -51.37 54.37 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 114.906 -1.043 . . . . 71.239999999999995 110.145 177.774 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.528 HH21 HG23 ' A' ' 13' ' ' ILE . 29.0 mmt-85 -65.8 -30.3 70.91 Favored 'General case' 0 N--CA 1.483 1.198 0 N-CA-C 113.039 0.755 . . . . 63.450000000000003 113.039 -179.097 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.411 ' O ' ' HG2' ' A' ' 61' ' ' MET . 19.9 t80 -56.3 -52.94 62.66 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 122.738 0.415 . . . . 75.310000000000002 110.502 171.605 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 67.8 mt-30 -73.42 -24.93 60.33 Favored 'General case' 0 CA--C 1.554 1.099 0 CA-C-N 115.574 -0.739 . . . . 72.510000000000005 112.074 -176.468 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.417 ' O ' ' HG ' ' A' ' 63' ' ' LEU . 21.2 mm-40 -71.27 -43.11 67.82 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.302 0.641 . . . . 72.530000000000001 110.166 172.823 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.486 HD21 ' HB3' ' A' ' 22' ' ' ASP . 25.3 mt -58.64 -45.69 88.74 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 124.31 1.044 . . . . 71.319999999999993 111.659 174.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.411 ' HG2' ' O ' ' A' ' 57' ' ' PHE . 35.5 mmt -58.07 -39.83 79.49 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.129 0.572 . . . . 60.25 111.167 175.722 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 20.0 tptt -71.63 -28.34 63.71 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-N 115.65 -0.704 . . . . 63.229999999999997 111.8 -178.606 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' A' ' 59' ' ' GLN . 96.4 mt -66.23 -31.67 72.62 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.288 0.635 . . . . 63.409999999999997 111.374 174.562 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 45.7 m-85 -76.31 -43.38 41.57 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 122.962 0.505 . . . . 73.420000000000002 111.16 173.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -62.15 -45.18 94.56 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.858 0.863 . . . . 72.109999999999999 112.509 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -120.13 179.72 4.19 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.687 0.795 . . . . 75.120000000000005 112.009 -174.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 70.4 m -143.59 103.1 4.04 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.101 0.96 . . . . 65.120000000000005 109.533 176.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 95.0 mttt 68.73 118.26 0.03 OUTLIER 'General case' 0 N--CA 1.502 2.131 0 C-N-CA 125.163 1.385 . . . . 62.109999999999999 112.288 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 83.0 m -72.05 -19.21 61.87 Favored 'General case' 0 N--CA 1.491 1.59 0 C-N-CA 124.118 0.967 . . . . 70.420000000000002 113.404 -172.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 80.9 mtm180 . . . . . 0 CA--C 1.571 1.774 0 C-N-CA 124.554 1.142 . . . . 62.109999999999999 113.135 177.945 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 56.3 m . . . . . 0 N--CA 1.483 1.221 0 CA-C-O 121.208 0.528 . . . . 73.200000000000003 110.761 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 39.4 m80 -131.41 106.99 8.61 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 124.428 1.091 . . . . 74.540000000000006 109.287 178.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 62.2 mtt -109.29 151.18 26.91 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 123.582 0.753 . . . . 74.510000000000005 111.294 -177.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm -69.57 90.43 0.56 Allowed 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 123.071 0.548 . . . . 73.430000000000007 111.249 178.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -116.43 111.91 20.7 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.992 0.917 . . . . 73.400000000000006 108.904 177.475 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 12.5 m -57.06 114.17 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 C-N-CA 123.362 0.665 . . . . 65.439999999999998 112.234 -177.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 8.5 tt -71.0 95.29 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.56 1.358 0 CA-C-O 122.31 1.052 . . . . 74.140000000000001 111.889 -177.566 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -86.5 85.83 7.32 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 115.3 -0.864 . . . . 73.310000000000002 109.16 171.293 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.42 52.15 2.28 Favored 'General case' 0 N--CA 1.489 1.488 0 CA-C-N 115.16 -0.927 . . . . 72.129999999999995 112.494 -173.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -70.83 113.89 8.35 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 123.853 0.861 . . . . 74.150000000000006 110.117 172.291 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 171.0 -145.72 9.13 Favored Glycine 0 CA--C 1.532 1.154 0 C-N-CA 121.757 -0.258 . . . . 65.310000000000002 113.298 -178.26 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -103.55 10.09 37.2 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 123.503 0.721 . . . . 73.219999999999999 112.755 -174.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 26.5 mm -71.09 110.31 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.285 0 N-CA-C 109.592 -0.522 . . . . 63.140000000000001 109.592 175.057 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 46.0 pt -95.93 0.13 10.5 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.519 0 C-N-CA 123.804 0.842 . . . . 70.319999999999993 112.126 -177.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 3.8 mp -96.38 128.64 47.39 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.948 0 C-N-CA 123.566 0.746 . . . . 74.409999999999997 109.444 -177.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 47.1 tp -71.58 101.36 2.48 Favored 'General case' 0 CA--C 1.556 1.185 0 CA-C-O 121.227 0.537 . . . . 42.210000000000001 110.902 179.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . 0.51 ' HZ2' ' HB3' ' A' ' 52' ' ' GLN . 93.2 m95 -112.13 167.6 10.27 Favored 'General case' 0 CA--C 1.56 1.347 0 C-N-CA 124.926 1.291 . . . . 65.040000000000006 110.512 176.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 80.6 p -119.54 -174.97 2.85 Favored 'General case' 0 N--CA 1.503 2.191 0 C-N-CA 123.746 0.818 . . . . 72.319999999999993 111.848 176.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 11.9 ptm180 -77.45 -18.59 57.05 Favored 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 123.243 0.617 . . . . 72.200000000000003 112.167 170.242 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.403 ' O ' HG23 ' A' ' 24' ' ' VAL . 77.9 m-20 -67.27 -36.08 80.84 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 123.499 0.719 . . . . 74.150000000000006 112.05 -176.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.38 -39.86 95.66 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 123.08 0.552 . . . . 74.200000000000003 111.035 -177.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.616 ' HA ' HD11 ' A' ' 60' ' ' LEU . 27.8 m-20 -49.93 -52.0 36.69 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 123.695 0.798 . . . . 73.340000000000003 111.313 175.487 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 42.0 ttt85 -58.77 -48.67 80.42 Favored 'General case' 0 CA--C 1.559 1.306 0 CA-C-N 114.834 -1.075 . . . . 74.450000000000003 112.707 176.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 20' ' ' ASN . 89.0 t -65.52 -44.65 94.0 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 C-N-CA 123.896 0.878 . . . . 74.040000000000006 112.314 -175.747 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 97.3 mt -69.03 -50.24 55.38 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.122 0 C-N-CA 123.711 0.804 . . . . 74.209999999999994 111.164 -178.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.482 HD11 HD22 ' A' ' 60' ' ' LEU . 95.3 mt -57.79 -27.87 63.5 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 112.421 0.526 . . . . 74.030000000000001 112.421 175.616 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 60.3 tp -74.49 -60.81 2.11 Favored 'General case' 0 CA--C 1.554 1.103 0 C-N-CA 122.954 0.502 . . . . 51.130000000000003 111.814 177.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.413 ' HB2' HD21 ' A' ' 42' ' ' LEU . 71.2 mm-40 -72.4 -26.35 61.84 Favored 'General case' 0 N--CA 1.488 1.442 0 N-CA-C 113.335 0.865 . . . . 74.140000000000001 113.335 -172.705 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 71.7 m -67.16 -44.38 79.89 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-O 120.948 0.404 . . . . 74.420000000000002 111.7 -178.567 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.6 pt20 -79.25 -32.41 43.77 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 122.618 0.367 . . . . 74.120000000000005 111.86 177.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 28.8 ttpp -80.27 -33.38 37.83 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.322 0.649 . . . . 75.340000000000003 112.279 -173.479 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 48.0 mtt180 -102.19 -59.93 1.62 Allowed 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 123.166 0.586 . . . . 73.530000000000001 111.77 179.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 164.15 173.34 32.7 Favored Glycine 0 CA--C 1.536 1.37 0 N-CA-C 114.66 0.624 . . . . 60.329999999999998 114.66 179.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 45.4 Cg_endo -87.65 3.15 6.41 Favored 'Trans proline' 0 CA--C 1.557 1.65 0 C-N-CA 123.47 2.78 . . . . 64.430000000000007 114.147 -177.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 32.3 t -65.07 151.11 46.86 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 123.782 0.833 . . . . 62.109999999999999 112.16 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 89.9 p -65.48 -18.38 65.27 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.314 0.646 . . . . 64.040000000000006 111.812 176.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.425 ' HD2' ' N ' ' A' ' 37' ' ' LYS . 0.2 OUTLIER -77.83 -15.01 59.38 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.745 0.818 . . . . 65.430000000000007 111.936 175.859 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 90.0 m -77.63 -39.55 44.88 Favored 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 108.845 -0.798 . . . . 72.140000000000001 108.845 169.817 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 92.9 m-85 -65.38 -30.25 71.05 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.045 0.938 . . . . 75.129999999999995 111.313 172.095 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.72 -35.84 65.15 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.454 0.702 . . . . 71.129999999999995 111.584 175.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 56.1 t80 -65.19 -42.39 93.65 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-O 121.47 0.653 . . . . 65.040000000000006 110.602 170.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.477 HD23 ' HD3' ' A' ' 45' ' ' LYS . 50.4 mt -64.94 -32.92 74.87 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.842 0.857 . . . . 64.310000000000002 111.543 175.638 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.7 -35.56 81.1 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.285 0.634 . . . . 61.439999999999998 111.535 174.083 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -65.71 -45.82 81.29 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.177 0.591 . . . . 60.439999999999998 112.07 177.368 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.477 ' HD3' HD23 ' A' ' 42' ' ' LEU . 18.0 ptmt -86.05 -22.99 26.93 Favored 'General case' 0 N--CA 1.489 1.494 0 N-CA-C 112.938 0.718 . . . . 72.209999999999994 112.938 -174.282 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 92.3 mt -90.55 -10.66 42.67 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 123.217 0.607 . . . . 74.319999999999993 111.475 171.393 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.3 t70 64.7 36.62 8.09 Favored 'General case' 0 CA--C 1.567 1.608 0 C-N-CA 124.269 1.027 . . . . 61.43 111.525 176.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -133.23 -168.69 2.13 Favored 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 124.005 0.922 . . . . 71.510000000000005 111.996 -176.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -85.86 144.98 40.22 Favored Pre-proline 0 N--CA 1.492 1.642 0 C-N-CA 123.335 0.654 . . . . 72.430000000000007 111.334 175.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_exo -61.33 -31.0 88.62 Favored 'Trans proline' 0 C--N 1.388 2.609 0 C-N-CA 122.911 2.407 . . . . 72.319999999999993 112.847 177.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -65.79 -37.13 85.47 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.062 0.945 . . . . 71.200000000000003 110.855 177.335 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.51 ' HB3' ' HZ2' ' A' ' 17' ' ' TRP . 75.2 mm-40 -75.5 -31.23 60.1 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.508 0.723 . . . . 71.0 112.187 179.193 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 94.8 t -63.32 -40.27 88.42 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.05 0 C-N-CA 122.827 0.451 . . . . 63.439999999999998 110.293 170.069 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 37.9 t -62.67 -39.46 94.01 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.387 0.675 . . . . 52.439999999999998 111.809 177.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -53.55 -53.75 47.15 Favored 'General case' 0 N--CA 1.491 1.611 0 CA-C-O 121.315 0.579 . . . . 72.310000000000002 110.679 174.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 9.7 mmm180 -61.1 -41.69 97.14 Favored 'General case' 0 N--CA 1.479 0.989 0 CA-C-N 114.634 -1.166 . . . . 72.5 112.919 -178.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 40.4 t80 -57.91 -51.12 70.94 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 124.029 0.932 . . . . 73.540000000000006 112.442 176.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 44.3 mt-30 -74.64 -24.81 58.89 Favored 'General case' 0 CA--C 1.555 1.148 0 CA-C-N 115.775 -0.648 . . . . 74.120000000000005 111.744 -176.05 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.461 ' O ' ' HG ' ' A' ' 63' ' ' LEU . 16.0 mm100 -75.47 -29.29 59.57 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 123.09 0.556 . . . . 75.439999999999998 110.692 170.068 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.616 HD11 ' HA ' ' A' ' 22' ' ' ASP . 9.8 mt -66.04 -41.75 90.47 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 123.827 0.851 . . . . 62.32 111.9 175.693 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 25.3 mmt -69.07 -26.96 65.21 Favored 'General case' 0 N--CA 1.484 1.238 0 CA-C-O 121.198 0.523 . . . . 71.030000000000001 111.321 175.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.9 ttmp? -72.14 -40.08 68.3 Favored 'General case' 0 CA--C 1.561 1.371 0 C-N-CA 124.111 0.964 . . . . 65.120000000000005 111.038 172.303 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' A' ' 59' ' ' GLN . 95.9 mt -70.55 -30.97 67.83 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 123.585 0.754 . . . . 64.010000000000005 111.494 175.272 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 54.9 t80 -67.2 -40.27 86.44 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.735 0.814 . . . . 74.349999999999994 110.319 178.893 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 32.1 tt0 -65.34 -39.01 91.86 Favored 'General case' 0 CA--C 1.555 1.157 0 C-N-CA 123.961 0.904 . . . . 74.219999999999999 111.232 172.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 45.8 mtpt 76.82 -29.36 0.17 Allowed 'General case' 0 N--CA 1.498 1.961 0 C-N-CA 126.129 1.772 . . . . 73.510000000000005 113.698 178.053 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 50.8 m -65.6 89.29 0.1 Allowed 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.665 0.786 . . . . 62.140000000000001 112.717 -173.127 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 10.4 tmtt? -74.77 83.23 2.13 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.93 0.892 . . . . 73.109999999999999 109.237 -179.356 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 39.0 t -105.01 -6.13 20.32 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 123.631 0.772 . . . . 61.140000000000001 111.764 -178.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 82.7 mtt180 . . . . . 0 C--O 1.254 1.317 0 C-N-CA 124.142 0.977 . . . . 74.329999999999998 110.634 176.982 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 41.9 t . . . . . 0 N--CA 1.492 1.672 0 CA-C-O 120.272 0.082 . . . . 54.130000000000003 110.979 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 70.6 m80 -138.67 130.32 27.64 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 124.048 0.939 . . . . 45.399999999999999 110.007 178.881 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 52.3 ttm -159.38 93.85 1.14 Allowed 'General case' 0 N--CA 1.481 1.085 0 CA-C-O 121.156 0.503 . . . . 73.120000000000005 111.088 -179.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 2.6 mppt? -113.02 121.31 44.23 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 123.414 0.686 . . . . 62.43 109.34 172.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 24.8 p-10 -143.51 176.46 9.17 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.121 0.568 . . . . 74.310000000000002 112.139 -176.176 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 43.8 t 58.67 87.04 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.424 0 C-N-CA 125.074 1.35 . . . . 73.219999999999999 112.031 177.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 36.6 mm -93.08 -25.39 4.97 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.216 0 CA-C-N 115.41 -0.814 . . . . 70.409999999999997 110.721 -179.162 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 60.4 tttp -82.72 102.55 11.6 Favored 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 123.163 0.585 . . . . 72.340000000000003 110.207 174.66 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 27.6 ttpp -99.05 143.36 29.41 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.838 0.855 . . . . 72.5 110.63 -178.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -90.63 46.8 1.36 Allowed 'General case' 0 N--CA 1.491 1.576 0 N-CA-C 113.036 0.754 . . . . 74.200000000000003 113.036 -172.476 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 79.63 -8.68 47.4 Favored Glycine 0 CA--C 1.539 1.559 0 N-CA-C 115.62 1.008 . . . . 75.129999999999995 115.62 173.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -68.41 123.94 22.16 Favored 'General case' 0 N--CA 1.476 0.871 0 CA-C-N 117.914 0.857 . . . . 74.230000000000004 109.416 177.329 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.555 HD11 HE21 ' A' ' 59' ' ' GLN . 28.7 mm 63.07 112.4 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.562 1.409 0 C-N-CA 125.226 1.41 . . . . 61.229999999999997 111.031 -166.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 2.4 mp -75.02 -29.71 22.46 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 C-N-CA 125.132 1.373 . . . . 60.310000000000002 111.054 -173.651 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 59.0 mt -66.21 137.92 23.98 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.272 0 C-N-CA 124.428 1.091 . . . . 63.210000000000001 111.87 -176.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 49.4 tp -73.47 85.92 1.53 Allowed 'General case' 0 CA--C 1.553 1.078 0 CA-C-O 121.44 0.638 . . . . 63.119999999999997 110.594 176.132 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 95.6 m95 -85.14 125.14 32.56 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 115.831 -0.622 . . . . 74.340000000000003 110.374 174.167 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . 0.508 ' OG1' ' HB2' ' A' ' 21' ' ' ASP . 41.4 p -89.7 148.22 23.41 Favored 'General case' 0 N--CA 1.479 0.997 0 N-CA-C 109.081 -0.711 . . . . 74.150000000000006 109.081 179.21 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 10.8 ptm180 -63.03 -20.09 64.99 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.28 0.632 . . . . 73.0 112.435 -172.44 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.461 ' O ' HG23 ' A' ' 24' ' ' VAL . 9.3 m120 -75.94 -47.09 26.55 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 123.507 0.723 . . . . 74.299999999999997 109.908 171.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.508 ' HB2' ' OG1' ' A' ' 18' ' ' THR . 0.4 OUTLIER -59.96 -55.79 29.76 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 125.208 1.403 . . . . 74.549999999999997 111.783 -173.563 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.565 ' HB2' HD21 ' A' ' 60' ' ' LEU . 1.6 p30 -64.49 -32.51 74.17 Favored 'General case' 0 CA--C 1.557 1.238 0 CA-C-N 115.735 -0.666 . . . . 73.430000000000007 112.573 179.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 70.2 ttt180 -64.58 -38.02 89.57 Favored 'General case' 0 CA--C 1.56 1.335 0 C-N-CA 123.011 0.524 . . . . 74.299999999999997 111.395 174.011 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.461 HG23 ' O ' ' A' ' 20' ' ' ASN . 99.1 t -67.69 -32.14 55.48 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 C-N-CA 123.182 0.593 . . . . 74.329999999999998 111.239 176.262 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 91.5 mt -56.6 -54.91 23.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 C-N-CA 122.238 0.215 . . . . 71.340000000000003 110.907 173.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.502 ' HG ' HD13 ' A' ' 60' ' ' LEU . 98.7 mt -57.8 -44.07 86.08 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 123.394 0.678 . . . . 71.099999999999994 111.757 176.184 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 39.5 tp -60.57 -49.46 77.46 Favored 'General case' 0 CA--C 1.561 1.397 0 C-N-CA 124.286 1.034 . . . . 62.520000000000003 112.452 -177.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -77.78 -20.35 53.47 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.575 0.75 . . . . 72.120000000000005 112.539 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 69.4 m -74.12 -29.27 61.75 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-O 120.846 0.355 . . . . 73.420000000000002 110.732 170.33 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 91.7 mt-30 -75.41 -19.58 59.43 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.215 0.606 . . . . 72.439999999999998 111.42 170.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 35.8 ttmt -82.88 -69.76 0.6 Allowed 'General case' 0 CA--C 1.559 1.302 0 C-N-CA 123.512 0.725 . . . . 75.230000000000004 111.407 173.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 51.6 mtp180 -81.07 -42.14 21.49 Favored 'General case' 0 N--CA 1.485 1.314 0 C-N-CA 123.582 0.753 . . . . 74.430000000000007 112.699 -174.377 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 122.74 161.08 11.11 Favored Glycine 0 CA--C 1.54 1.609 0 CA-C-O 119.711 -0.494 . . . . 63.310000000000002 112.784 -175.335 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -69.27 92.66 0.47 Allowed 'Trans proline' 0 C--N 1.374 1.901 0 C-N-CA 122.608 2.206 . . . . 61.100000000000001 111.914 173.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 43.6 t -148.47 157.74 43.66 Favored 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 123.084 0.554 . . . . 61.020000000000003 112.287 -174.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 95.4 p -63.63 -29.54 70.77 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 123.569 0.747 . . . . 75.150000000000006 111.092 175.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 34.1 mmtp -63.57 -34.88 78.78 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.772 0.829 . . . . 64.109999999999999 111.019 175.174 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 21.5 m -82.94 -33.32 26.78 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 115.249 -0.887 . . . . 71.109999999999999 110.054 -177.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -68.63 -38.17 80.29 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.372 0.669 . . . . 54.32 111.104 175.474 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -69.35 -35.3 75.74 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.378 0.671 . . . . 61.340000000000003 111.275 174.252 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -66.43 -47.71 72.33 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 123.522 0.729 . . . . 65.239999999999995 111.435 177.08 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.412 ' HB2' HG11 ' A' ' 53' ' ' VAL . 25.9 mt -69.17 -24.22 64.03 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.49 1.116 . . . . 73.540000000000006 111.986 176.347 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.51 -47.34 82.11 Favored 'General case' 0 CA--C 1.548 0.898 0 CA-C-O 121.091 0.472 . . . . 73.319999999999993 110.601 170.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -68.09 -39.69 82.81 Favored 'General case' 0 CA--C 1.557 1.213 0 C-N-CA 123.588 0.755 . . . . 71.540000000000006 112.058 177.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 32.3 ttmt -73.94 -36.51 64.66 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 124.094 0.958 . . . . 52.439999999999998 112.223 -176.568 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 82.6 mt -108.27 9.56 27.94 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 112.882 0.697 . . . . 73.439999999999998 112.882 -174.202 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 66.71 11.73 8.38 Favored 'General case' 0 N--CA 1.503 2.194 0 C-N-CA 124.73 1.212 . . . . 64.549999999999997 112.944 -179.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm -91.65 -163.99 1.12 Allowed 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 124.068 0.947 . . . . 74.099999999999994 112.049 -175.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -124.81 149.75 63.64 Favored Pre-proline 0 CA--C 1.567 1.63 0 C-N-CA 124.087 0.955 . . . . 74.209999999999994 109.212 174.464 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_exo -48.68 -44.22 31.68 Favored 'Trans proline' 0 C--N 1.391 2.769 0 C-N-CA 123.782 2.988 . . . . 71.530000000000001 115.755 -173.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -68.51 -35.22 77.18 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 122.51 0.324 . . . . 73.430000000000007 111.315 -179.279 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 -62.69 -45.97 90.34 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 123.345 0.658 . . . . 74.200000000000003 111.076 175.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.412 HG11 ' HB2' ' A' ' 42' ' ' LEU . 98.8 t -62.2 -40.7 88.6 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.04 0 CA-C-N 115.503 -0.771 . . . . 54.310000000000002 111.252 176.525 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 47.0 t -68.71 -45.13 72.38 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.902 0.881 . . . . 74.219999999999999 112.765 -175.711 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -64.88 -42.16 95.06 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 122.694 0.398 . . . . 73.150000000000006 110.878 178.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 22.3 tpt180 -66.39 -39.34 88.99 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 122.592 0.357 . . . . 70.510000000000005 110.785 177.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 34.4 t80 -51.24 -53.13 38.3 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 124.57 1.148 . . . . 73.219999999999999 112.371 178.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -73.66 -23.09 59.8 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 112.72 0.637 . . . . 74.340000000000003 112.72 -177.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.555 HE21 HD11 ' A' ' 13' ' ' ILE . 2.6 mp0 -75.88 -26.0 56.65 Favored 'General case' 0 N--CA 1.488 1.475 0 C-N-CA 123.208 0.603 . . . . 74.150000000000006 110.783 172.233 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.565 HD21 ' HB2' ' A' ' 22' ' ' ASP . 42.1 mt -74.6 -40.72 61.41 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.818 0.847 . . . . 75.230000000000004 110.98 171.587 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.543 ' HA ' ' HD2' ' A' ' 64' ' ' PHE . 84.0 mtp -70.99 -27.32 63.62 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.436 0.694 . . . . 62.329999999999998 111.202 176.54 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -57.19 -38.41 73.61 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.029 0.931 . . . . 60.509999999999998 110.846 169.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 78.3 mt -65.74 -39.21 90.88 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.272 0.629 . . . . 74.329999999999998 111.496 176.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.543 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 52.3 m-85 -66.99 -30.17 70.21 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 122.803 0.441 . . . . 62.43 111.762 175.714 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -71.04 -48.18 54.32 Favored 'General case' 0 CA--C 1.554 1.107 0 CA-C-O 120.844 0.354 . . . . 54.340000000000003 110.532 173.051 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 88.6 tttt -168.86 125.41 0.96 Allowed 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.649 0.78 . . . . 75.430000000000007 111.276 -177.59 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 70.7 m -108.13 137.46 46.08 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 123.622 0.769 . . . . 75.219999999999999 110.627 175.556 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 92.8 mttt -116.9 -165.12 1.03 Allowed 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.59 0.756 . . . . 72.209999999999994 111.944 179.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 47.5 t 67.33 81.97 0.19 Allowed 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 125.117 1.367 . . . . 74.450000000000003 110.623 -173.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.407 ' H ' ' HG3' ' A' ' 70' ' ' ARG . 5.3 ppt_? . . . . . 0 CA--C 1.569 1.684 0 C-N-CA 123.79 0.836 . . . . 74.400000000000006 112.545 -177.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 39.6 m . . . . . 0 N--CA 1.492 1.63 0 N-CA-C 110.532 -0.173 . . . . 73.129999999999995 110.532 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 40.7 t-80 -78.05 82.98 4.37 Favored 'General case' 0 N--CA 1.485 1.283 0 CA-C-O 121.236 0.541 . . . . 73.439999999999998 109.708 177.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 49.5 ttm -89.63 135.42 33.62 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.369 0.668 . . . . 74.239999999999995 111.002 -175.622 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -115.55 130.92 57.04 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.193 0.997 . . . . 63.219999999999999 109.279 173.482 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 34.4 t-20 -89.1 87.9 7.36 Favored 'General case' 0 CA--C 1.557 1.243 0 N-CA-C 109.39 -0.596 . . . . 63.32 109.39 177.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 11.1 p -67.97 -35.09 70.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 C-N-CA 123.285 0.634 . . . . 62.310000000000002 111.93 -177.369 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.505 HG13 ' H ' ' A' ' 9' ' ' LYS . 34.6 pt -77.32 -26.11 15.39 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.258 0 C-N-CA 123.425 0.69 . . . . 63.109999999999999 111.549 179.769 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 53.1 mtmt 60.51 32.46 20.48 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 124.906 1.282 . . . . 73.5 113.362 178.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.505 ' H ' HG13 ' A' ' 7' ' ' ILE . 1.2 mptm? -98.04 176.97 5.57 Favored 'General case' 0 CA--C 1.558 1.262 0 C-N-CA 123.864 0.866 . . . . 72.140000000000001 110.317 171.087 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 58.5 mttp 67.73 -72.18 0.1 Allowed 'General case' 0 N--CA 1.498 1.931 0 C-N-CA 125.175 1.39 . . . . 72.140000000000001 112.343 -178.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -69.66 87.66 0.28 Allowed Glycine 0 C--N 1.353 1.48 0 C-N-CA 122.976 0.322 . . . . 62.409999999999997 113.492 179.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -83.37 135.09 34.84 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.046 0.538 . . . . 73.200000000000003 111.044 -179.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 24.1 mm -79.21 -8.74 11.77 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.736 0 C-N-CA 124.03 0.932 . . . . 73.319999999999993 112.884 -168.444 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.609 HG23 HG12 ' A' ' 15' ' ' ILE . 11.2 tt -50.45 -34.45 11.81 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.162 0 CA-C-O 121.938 0.875 . . . . 73.140000000000001 112.053 176.425 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.609 HG12 HG23 ' A' ' 14' ' ' ILE . 4.6 pt -129.04 100.91 5.97 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 CA-C-N 114.654 -1.157 . . . . 62.43 109.759 178.188 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 41.8 tp -75.94 78.23 2.83 Favored 'General case' 0 CA--C 1.55 0.969 0 CA-C-O 121.709 0.766 . . . . 43.539999999999999 110.173 178.449 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . 0.446 ' CH2' ' HG3' ' A' ' 48' ' ' LYS . 99.0 m95 -80.67 123.63 28.33 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-N 114.926 -1.034 . . . . 71.530000000000001 110.04 169.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 21.7 p -111.72 164.28 13.21 Favored 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 108.551 -0.907 . . . . 53.420000000000002 108.551 174.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 27.3 ptt-85 -57.59 -19.84 28.49 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.305 0.642 . . . . 51.119999999999997 112.465 178.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.444 ' O ' HG23 ' A' ' 24' ' ' VAL . 28.0 m-80 -70.86 -49.31 47.44 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.45 0.7 . . . . 64.409999999999997 110.754 174.556 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 26.4 m-20 -62.24 -57.05 12.86 Favored 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 123.676 0.79 . . . . 71.239999999999995 112.272 -176.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.462 ' HB2' HD11 ' A' ' 60' ' ' LEU . 2.2 p30 -64.68 -31.89 73.31 Favored 'General case' 0 CA--C 1.555 1.162 0 C-N-CA 123.335 0.654 . . . . 72.310000000000002 112.399 -176.285 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -62.75 -39.24 93.54 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.557 0.743 . . . . 74.400000000000006 111.821 174.955 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.444 HG23 ' O ' ' A' ' 20' ' ' ASN . 62.4 t -65.61 -38.45 82.37 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 C-N-CA 122.969 0.508 . . . . 62.43 110.577 174.437 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 70.5 mt -59.87 -47.16 92.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 CA-C-O 120.96 0.409 . . . . 71.409999999999997 110.951 174.641 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.44 HD11 HD22 ' A' ' 60' ' ' LEU . 88.9 mt -62.86 -36.81 84.5 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.201 1.0 . . . . 54.329999999999998 112.09 178.255 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 53.5 tp -67.71 -53.85 24.22 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.339 0.656 . . . . 73.140000000000001 111.289 178.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.51 ' HA ' ' HB3' ' A' ' 31' ' ' LYS . 8.2 mm-40 -71.12 -20.78 62.28 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 123.737 0.815 . . . . 74.040000000000006 112.426 -176.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 35.7 t -67.05 -30.97 71.18 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.091 0.557 . . . . 53.450000000000003 111.699 171.316 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 24.3 mm-40 -96.86 -23.69 16.24 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.0 0.52 . . . . 74.349999999999994 111.501 177.598 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.51 ' HB3' ' HA ' ' A' ' 28' ' ' GLU . 58.6 tptt -76.17 -58.01 3.53 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.896 0.879 . . . . 71.209999999999994 110.649 179.37 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -90.82 -60.27 1.96 Allowed 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.641 0.777 . . . . 74.239999999999995 109.818 176.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 148.15 178.94 23.72 Favored Glycine 0 CA--C 1.536 1.375 0 CA-C-N 115.11 -0.95 . . . . 65.120000000000005 112.285 -175.245 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -82.83 35.77 0.59 Allowed 'Trans proline' 0 CA--C 1.562 1.906 0 C-N-CA 123.21 2.606 . . . . 64.329999999999998 112.762 174.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 30.3 t -72.36 145.54 47.68 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.959 0.904 . . . . 44.420000000000002 111.455 -179.342 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 80.2 p -61.3 -31.93 71.77 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 123.317 0.647 . . . . 74.5 111.311 173.365 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 8.1 tmtm? -65.34 -33.68 76.55 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 124.406 1.082 . . . . 75.140000000000001 110.889 174.657 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 56.2 m -75.04 -38.99 61.27 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.344 0.658 . . . . 45.409999999999997 109.786 -179.116 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 28.1 m-85 -67.26 -32.48 73.53 Favored 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 123.527 0.731 . . . . 71.409999999999997 112.066 174.46 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -73.14 -34.68 66.23 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.598 0.759 . . . . 64.549999999999997 111.324 174.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -63.0 -48.81 77.22 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 123.587 0.755 . . . . 72.319999999999993 110.536 172.277 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.458 ' HB2' HG11 ' A' ' 53' ' ' VAL . 44.4 mt -64.94 -29.31 70.24 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 124.644 1.178 . . . . 75.030000000000001 112.226 177.415 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -63.76 -50.53 68.69 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.13 0.572 . . . . 55.520000000000003 110.993 171.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.1 -27.6 62.75 Favored 'General case' 0 CA--C 1.558 1.282 0 C-N-CA 123.16 0.584 . . . . 72.099999999999994 112.368 179.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.53 -51.76 11.08 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.809 0.844 . . . . 55.520000000000003 109.959 -178.593 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 63.5 mt -87.1 2.53 49.46 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.872 0.869 . . . . 63.039999999999999 111.897 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 62.29 24.02 14.26 Favored 'General case' 0 N--CA 1.497 1.913 0 C-N-CA 124.67 1.188 . . . . 71.310000000000002 113.035 178.546 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.446 ' HG3' ' CH2' ' A' ' 17' ' ' TRP . 72.2 mmtt -96.94 -167.62 1.58 Allowed 'General case' 0 CA--C 1.558 1.252 0 C-N-CA 124.948 1.299 . . . . 73.430000000000007 111.144 177.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.435 HD22 ' NE2' ' A' ' 52' ' ' GLN . 24.8 m-80 -105.81 144.55 29.12 Favored Pre-proline 0 N--CA 1.492 1.631 0 C-N-CA 123.683 0.793 . . . . 75.230000000000004 110.376 175.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -63.32 -29.8 72.9 Favored 'Trans proline' 0 C--N 1.384 2.417 0 C-N-CA 122.794 2.329 . . . . 63.039999999999999 113.037 -175.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -61.12 -49.69 76.23 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.014 0.926 . . . . 73.209999999999994 110.334 174.748 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.467 ' O ' ' HG2' ' A' ' 56' ' ' ARG . 76.3 mt-30 -55.4 -55.64 29.36 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 115.391 -0.822 . . . . 75.439999999999998 111.492 176.719 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.458 HG11 ' HB2' ' A' ' 42' ' ' LEU . 84.6 t -55.98 -45.79 80.3 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.305 0 C-N-CA 124.036 0.934 . . . . 43.310000000000002 112.468 -174.35 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 32.8 t -61.39 -43.84 98.18 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 123.377 0.671 . . . . 64.109999999999999 111.698 178.594 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 51.0 mt-10 -65.89 -44.93 83.8 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.352 0.661 . . . . 73.219999999999999 111.801 178.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.467 ' HG2' ' O ' ' A' ' 52' ' ' GLN . 2.4 mmp_? -65.71 -35.82 81.85 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 122.492 0.317 . . . . 74.120000000000005 111.094 -176.35 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.518 ' HA ' HD12 ' A' ' 60' ' ' LEU . 17.0 t80 -53.77 -49.86 67.3 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 123.959 0.904 . . . . 60.25 111.708 172.241 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -71.8 -25.0 61.82 Favored 'General case' 0 CA--C 1.552 1.034 0 CA-C-N 115.506 -0.77 . . . . 74.299999999999997 111.64 -176.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -76.29 -39.4 54.31 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.033 0.533 . . . . 70.030000000000001 110.527 173.017 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.518 HD12 ' HA ' ' A' ' 57' ' ' PHE . 16.3 mt -54.26 -46.34 72.61 Favored 'General case' 0 N--CA 1.493 1.689 0 C-N-CA 124.712 1.205 . . . . 74.209999999999994 111.563 177.27 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 31.7 mmt -56.06 -44.65 79.08 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 123.77 0.828 . . . . 60.130000000000003 111.498 175.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 62.1 mttp -71.09 -29.36 65.19 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.641 0.776 . . . . 73.230000000000004 112.512 178.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 93.0 mt -70.13 -38.88 75.66 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.095 0.558 . . . . 72.099999999999994 111.319 177.19 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 30.3 m-85 -62.29 -24.67 67.43 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 122.639 0.376 . . . . 72.25 111.943 174.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -80.62 -59.91 2.51 Favored 'General case' 0 CA--C 1.556 1.179 0 C-N-CA 123.271 0.628 . . . . 74.340000000000003 110.693 174.235 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 8.5 mtmp? -158.79 -169.16 2.61 Favored 'General case' 0 N--CA 1.504 2.225 0 C-N-CA 125.142 1.377 . . . . 72.439999999999998 110.659 -173.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 23.0 t 67.53 16.4 9.92 Favored 'General case' 0 N--CA 1.502 2.15 0 N-CA-C 114.639 1.348 . . . . 62.409999999999997 114.639 164.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 35.1 mtmm -71.48 122.06 19.75 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 112.939 0.718 . . . . 72.540000000000006 112.939 179.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 84.6 m -135.56 120.65 18.82 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 124.433 1.093 . . . . 65.420000000000002 109.115 170.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.561 1.397 0 C-N-CA 123.645 0.778 . . . . 72.239999999999995 109.255 -178.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 78.8 p . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 120.821 0.343 . . . . 51.439999999999998 111.476 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 69.8 t60 -154.69 152.34 29.81 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.773 0.829 . . . . 71.420000000000002 110.504 177.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 24.5 mmt -74.09 156.97 36.87 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-O 121.362 0.601 . . . . 63.039999999999999 112.058 178.38 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 4.7 ttmp? -85.21 149.2 25.67 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 124.122 0.969 . . . . 72.430000000000007 113.069 -169.242 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 24.2 p-10 -79.68 143.28 34.75 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.323 0.649 . . . . 60.130000000000003 111.027 174.652 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 68.9 t -96.68 126.61 49.34 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 C-N-CA 123.177 0.591 . . . . 74.409999999999997 110.57 176.516 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 1.7 mp -72.06 106.96 2.68 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.087 0 N-CA-C 108.858 -0.793 . . . . 41.009999999999998 108.858 175.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.409 ' HD3' ' O ' ' A' ' 9' ' ' LYS . 14.2 tmtt? -68.25 -45.15 73.99 Favored 'General case' 0 CA--C 1.558 1.287 0 C-N-CA 123.687 0.795 . . . . 74.239999999999995 110.893 -176.263 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.409 ' O ' ' HD3' ' A' ' 8' ' ' LYS . 38.5 ttmt 63.69 167.84 0.15 Allowed 'General case' 0 N--CA 1.502 2.165 0 C-N-CA 124.725 1.21 . . . . 64.329999999999998 111.82 -178.6 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.405 ' N ' ' HG2' ' A' ' 9' ' ' LYS . 34.8 mtmt 68.25 108.8 0.05 OUTLIER 'General case' 0 N--CA 1.495 1.782 0 C-N-CA 124.15 0.98 . . . . 72.400000000000006 111.738 174.194 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -62.53 102.39 0.49 Allowed Glycine 0 CA--C 1.536 1.356 0 N-CA-C 114.96 0.744 . . . . 53.130000000000003 114.96 -172.245 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 27.6 tt0 -101.63 158.82 15.82 Favored 'General case' 0 N--CA 1.481 1.12 0 C-N-CA 123.734 0.813 . . . . 75.340000000000003 110.496 179.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.499 HD12 ' H ' ' A' ' 13' ' ' ILE . 2.6 mp -85.67 59.14 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 CA-C-O 122.736 1.255 . . . . 72.040000000000006 110.068 -174.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 45.8 pt -122.14 6.22 5.75 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.448 0 C-N-CA 125.435 1.494 . . . . 63.409999999999997 111.019 178.251 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 17.3 mm 69.33 111.42 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 C-N-CA 125.674 1.59 . . . . 61.140000000000001 110.508 -170.032 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 6.0 mp -78.84 70.67 5.22 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.959 0.904 . . . . 73.420000000000002 111.61 -173.58 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . 0.474 ' HZ2' ' HB3' ' A' ' 52' ' ' GLN . 96.7 m95 -68.42 126.91 31.09 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.531 0.732 . . . . 75.450000000000003 111.407 177.681 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 25.9 p -103.17 164.6 11.52 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 120.979 0.419 . . . . 75.5 111.111 177.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.46 ' HA ' ' HE ' ' A' ' 19' ' ' ARG . 0.4 OUTLIER -60.34 -21.89 62.6 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.965 0.906 . . . . 73.25 112.377 -177.715 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -74.97 -49.51 19.76 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 123.739 0.816 . . . . 61.43 110.902 176.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 59.9 m-20 -59.82 -53.32 59.32 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 123.471 0.708 . . . . 71.219999999999999 112.092 -175.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.601 ' HB2' HD21 ' A' ' 60' ' ' LEU . 2.9 p30 -62.66 -32.42 73.47 Favored 'General case' 0 CA--C 1.561 1.372 0 CA-C-N 115.371 -0.832 . . . . 61.109999999999999 112.216 -177.579 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 35.7 ttm180 -70.54 -40.39 73.44 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.764 0.825 . . . . 73.040000000000006 111.57 176.758 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 45.8 t -61.81 -39.6 84.01 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.344 0 C-N-CA 123.665 0.786 . . . . 74.409999999999997 111.22 175.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 90.8 mt -56.24 -53.96 33.41 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.331 0 C-N-CA 123.206 0.602 . . . . 64.430000000000007 111.219 174.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 96.5 mt -62.49 -46.85 86.57 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.267 0.627 . . . . 75.150000000000006 112.18 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 49.1 tp -61.89 -50.3 72.75 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.973 0.909 . . . . 71.530000000000001 112.145 -174.644 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.522 ' HB2' HD21 ' A' ' 42' ' ' LEU . 31.1 mt-10 -76.85 -18.27 58.47 Favored 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 112.757 0.651 . . . . 74.230000000000004 112.757 -179.01 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 61.9 m -70.02 -29.43 66.48 Favored 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 122.508 0.323 . . . . 63.439999999999998 111.108 165.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 -83.7 -20.58 33.25 Favored 'General case' 0 N--CA 1.492 1.626 0 C-N-CA 122.901 0.481 . . . . 74.450000000000003 111.984 174.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 73.2 mmtt -74.05 -44.72 53.28 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 122.996 0.519 . . . . 73.209999999999994 110.422 171.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 73.9 mtp180 -108.83 -70.98 0.78 Allowed 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.641 0.776 . . . . 75.209999999999994 111.954 -173.202 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 155.62 147.57 4.76 Favored Glycine 0 CA--C 1.54 1.617 0 CA-C-O 119.059 -0.856 . . . . 34.119999999999997 112.197 -175.292 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -65.67 86.2 0.22 Allowed 'Trans proline' 0 C--N 1.378 2.116 0 C-N-CA 123.234 2.623 . . . . 71.25 112.622 175.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 29.3 t -130.26 155.36 46.42 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 124.023 0.929 . . . . 62.43 110.818 -177.544 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 81.9 p -66.89 -29.41 69.3 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.259 0.623 . . . . 65.5 111.671 176.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -68.26 -32.06 71.97 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.148 0.579 . . . . 72.540000000000006 110.849 172.258 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 66.8 m -79.79 -33.51 40.47 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.218 0.607 . . . . 70.310000000000002 109.604 -179.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -69.43 -32.77 71.94 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.396 0.678 . . . . 73.510000000000005 111.048 173.195 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -70.8 -35.2 72.43 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.533 0.733 . . . . 75.120000000000005 111.287 173.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -62.93 -50.57 70.3 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 123.478 0.711 . . . . 73.109999999999999 111.121 172.075 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.522 HD21 ' HB2' ' A' ' 28' ' ' GLU . 54.8 mt -66.44 -23.38 66.28 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 124.411 1.085 . . . . 60.130000000000003 111.894 178.697 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -65.12 -45.99 82.83 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.15 0.58 . . . . 65.109999999999999 111.166 169.412 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.1 -32.56 65.05 Favored 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 123.347 0.659 . . . . 71.349999999999994 111.953 176.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.45 ' HB3' ' HA ' ' A' ' 42' ' ' LEU . 23.8 tptp -76.92 -34.24 57.69 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.906 1.282 . . . . 73.030000000000001 111.677 -173.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 92.2 mt -102.82 -5.24 23.84 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 123.73 0.812 . . . . 65.319999999999993 112.14 175.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.3 t70 65.2 31.53 10.72 Favored 'General case' 0 CA--C 1.574 1.883 0 C-N-CA 124.583 1.153 . . . . 70.400000000000006 111.215 -178.162 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -110.03 -177.2 3.19 Favored 'General case' 0 N--CA 1.495 1.812 0 C-N-CA 124.53 1.132 . . . . 75.319999999999993 111.984 -178.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -85.98 140.98 35.13 Favored Pre-proline 0 N--CA 1.489 1.489 0 C-N-CA 123.293 0.637 . . . . 72.409999999999997 110.853 173.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -66.63 -24.68 47.84 Favored 'Trans proline' 0 C--N 1.38 2.222 0 C-N-CA 122.4 2.067 . . . . 44.240000000000002 113.039 -177.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -67.34 -47.05 71.64 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.522 0.729 . . . . 64.030000000000001 110.186 173.293 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.474 ' HB3' ' HZ2' ' A' ' 17' ' ' TRP . 84.2 mm-40 -60.62 -32.5 71.64 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.695 0.798 . . . . 55.219999999999999 112.081 177.112 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.479 HG11 ' HB2' ' A' ' 42' ' ' LEU . 88.8 t -74.95 -45.12 43.9 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.224 0 C-N-CA 123.859 0.864 . . . . 64.010000000000005 111.681 177.979 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 87.4 p -63.91 -42.51 97.38 Favored 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 123.1 0.56 . . . . 74.230000000000004 111.318 -179.639 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -60.61 -41.29 94.47 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.714 0.805 . . . . 73.5 111.432 172.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 1.2 tpp180 -64.16 -42.86 96.56 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 122.985 0.514 . . . . 74.329999999999998 111.736 -174.023 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -51.38 -48.65 62.48 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 124.002 0.921 . . . . 73.439999999999998 111.626 173.271 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -73.27 -32.52 64.71 Favored 'General case' 0 CA--C 1.552 1.049 0 CA-C-N 115.551 -0.75 . . . . 75.239999999999995 112.301 -174.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.41 ' O ' ' HG ' ' A' ' 63' ' ' LEU . 17.6 mm-40 -70.94 -41.76 70.71 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.296 0.638 . . . . 74.209999999999994 110.479 175.24 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.601 HD21 ' HB2' ' A' ' 22' ' ' ASP . 7.5 mt -53.11 -44.11 67.38 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 124.908 1.283 . . . . 62.130000000000003 112.787 -179.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 31.6 mmt -55.28 -43.47 74.78 Favored 'General case' 0 CA--C 1.558 1.288 0 O-C-N 123.962 0.789 . . . . 74.530000000000001 111.11 177.075 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -75.91 -29.8 58.54 Favored 'General case' 0 CA--C 1.558 1.279 0 C-N-CA 124.336 1.054 . . . . 72.340000000000003 112.623 178.113 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 59' ' ' GLN . 93.7 mt -71.06 -30.6 66.8 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 123.7 0.8 . . . . 70.150000000000006 112.281 -178.176 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 44.0 m-85 -57.09 -53.62 56.02 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 122.795 0.438 . . . . 62.420000000000002 110.934 174.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -73.77 -28.12 61.51 Favored 'General case' 0 CA--C 1.556 1.208 0 C-N-CA 123.134 0.574 . . . . 73.219999999999999 111.559 178.442 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 65.6 tttp 61.1 79.1 0.26 Allowed 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 124.84 1.256 . . . . 61.520000000000003 110.957 179.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 31.4 t -131.38 22.39 4.77 Favored 'General case' 0 N--CA 1.491 1.598 0 CA-C-N 115.393 -0.821 . . . . 74.450000000000003 111.453 -175.957 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 29.9 mtpp -126.42 94.66 4.13 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 123.449 0.699 . . . . 72.140000000000001 111.467 -178.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 87.4 m -91.61 89.49 7.18 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 123.245 0.618 . . . . 34.509999999999998 109.672 170.66 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 26.1 tpt180 . . . . . 0 CA--C 1.564 1.513 0 CA-C-O 118.641 -0.695 . . . . 61.119999999999997 110.648 -179.402 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 41.1 t . . . . . 0 N--CA 1.486 1.356 0 N-CA-C 111.689 0.255 . . . . 71.109999999999999 111.689 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 30.1 m-70 63.0 12.98 6.31 Favored 'General case' 0 N--CA 1.498 1.973 0 C-N-CA 124.469 1.108 . . . . 74.230000000000004 113.034 -172.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 25.6 mmt -79.98 133.11 36.15 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 108.14 -1.059 . . . . 61.439999999999998 108.14 167.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -56.48 151.22 13.73 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.154 0.582 . . . . 70.109999999999999 112.245 -179.014 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 16.6 m120 -60.14 132.68 54.67 Favored 'General case' 0 N--CA 1.479 0.992 0 N-CA-C 108.873 -0.788 . . . . 64.450000000000003 108.873 170.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 64.7 t -53.46 102.41 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.831 0 C-N-CA 123.16 0.584 . . . . 73.420000000000002 112.151 -170.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 54.5 mt -83.09 121.7 36.43 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 C-N-CA 123.799 0.839 . . . . 72.450000000000003 110.086 -177.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 49.5 tptt -94.15 -57.11 2.61 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 122.941 0.496 . . . . 72.310000000000002 111.533 -176.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 15.2 tppt? 61.87 97.91 0.03 OUTLIER 'General case' 0 CA--C 1.561 1.39 0 C-N-CA 124.819 1.248 . . . . 64.420000000000002 112.027 -172.003 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -140.52 62.03 1.5 Allowed 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 124.601 1.16 . . . . 72.420000000000002 108.634 178.739 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -73.08 -64.72 2.46 Favored Glycine 0 C--N 1.35 1.347 0 CA-C-N 115.337 -0.847 . . . . 55.509999999999998 113.358 -175.517 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -96.37 169.53 9.86 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.243 0.617 . . . . 73.209999999999994 110.553 175.18 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.2 mp -93.02 130.88 41.45 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.267 0 C-N-CA 123.013 0.525 . . . . 72.340000000000003 110.375 -175.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 10.4 tt -147.02 76.76 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 C-N-CA 124.53 1.132 . . . . 55.229999999999997 108.51 173.173 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 27.1 mt 67.14 140.11 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.495 1.795 0 C-N-CA 124.93 1.292 . . . . 60.530000000000001 111.488 -176.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.9 mp -76.33 83.82 3.1 Favored 'General case' 0 N--CA 1.484 1.232 0 CA-C-O 121.995 0.903 . . . . 71.209999999999994 111.289 -179.292 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 85.1 m95 -97.97 134.56 40.9 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.175 1.39 . . . . 71.25 109.869 174.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 24.8 p -98.47 156.61 16.69 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 109.293 -0.632 . . . . 52.219999999999999 109.293 176.06 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 6.3 ptm180 -58.47 -21.16 50.6 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 113.869 1.062 . . . . 73.439999999999998 113.869 -173.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.445 ' O ' HG23 ' A' ' 24' ' ' VAL . 3.6 t-20 -74.32 -49.16 24.1 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 122.784 0.433 . . . . 73.129999999999995 110.403 176.582 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -56.6 -58.09 9.57 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.24 1.016 . . . . 74.230000000000004 113.287 -177.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.577 ' HB2' HD11 ' A' ' 60' ' ' LEU . 3.0 p30 -63.36 -31.73 72.97 Favored 'General case' 0 CA--C 1.56 1.342 0 C-N-CA 122.748 0.419 . . . . 63.229999999999997 111.914 -177.752 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 42.7 ttt-85 -64.97 -35.48 81.32 Favored 'General case' 0 N--CA 1.484 1.225 0 C-N-CA 123.261 0.624 . . . . 72.239999999999995 111.541 174.862 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.445 HG23 ' O ' ' A' ' 20' ' ' ASN . 90.2 t -70.77 -33.77 53.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.37 0 C-N-CA 123.276 0.631 . . . . 44.329999999999998 111.017 174.783 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 95.0 mt -57.93 -46.99 87.52 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 CA-C-O 120.707 0.289 . . . . 71.5 110.419 172.503 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.638 HD21 ' HB3' ' A' ' 60' ' ' LEU . 96.1 mt -60.77 -38.5 85.48 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.845 0.858 . . . . 71.549999999999997 112.313 176.392 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 40.4 tp -68.9 -47.44 65.8 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 123.462 0.705 . . . . 71.239999999999995 111.733 -179.434 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -75.69 -23.59 56.19 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.301 0.64 . . . . 74.239999999999995 111.913 -179.19 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.455 ' SG ' ' HE1' ' A' ' 57' ' ' PHE . 34.7 t -64.76 -31.03 72.07 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.417 0.687 . . . . 74.239999999999995 111.284 171.816 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -88.58 -31.53 18.57 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.467 0.707 . . . . 73.109999999999999 111.648 176.222 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -78.63 -70.17 0.51 Allowed 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.0 0.52 . . . . 61.140000000000001 111.105 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 7.2 mpt_? -70.46 -28.62 65.15 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 123.688 0.795 . . . . 73.409999999999997 112.102 178.569 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 95.16 167.8 35.87 Favored Glycine 0 CA--C 1.536 1.348 0 CA-C-O 119.493 -0.615 . . . . 63.200000000000003 112.579 -175.491 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_exo -72.62 87.72 0.94 Allowed 'Trans proline' 0 C--N 1.373 1.841 0 C-N-CA 122.606 2.204 . . . . 65.540000000000006 111.956 175.022 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 45.8 t -135.56 158.36 44.59 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 123.356 0.662 . . . . 72.219999999999999 111.515 -177.509 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 64.4 p -63.65 -38.66 91.96 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 123.701 0.8 . . . . 74.140000000000001 111.863 177.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 57.8 pttt -73.55 -11.15 60.35 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 123.283 0.633 . . . . 70.420000000000002 112.382 177.253 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 56.6 m -78.36 -40.38 36.52 Favored 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 108.97 -0.752 . . . . 73.120000000000005 108.97 174.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 49.1 m-85 -65.91 -33.37 75.67 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.673 0.789 . . . . 73.129999999999995 111.145 173.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -67.82 -41.46 83.04 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.361 0.664 . . . . 62.130000000000003 111.39 174.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 89.5 t80 -62.07 -50.4 72.1 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 122.883 0.473 . . . . 75.019999999999996 110.59 173.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.402 ' HA ' ' HB3' ' A' ' 45' ' ' LYS . 59.4 mt -63.33 -23.71 67.54 Favored 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 124.84 1.256 . . . . 72.230000000000004 112.7 178.627 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . 0.556 ' HA ' ' O ' ' A' ' 48' ' ' LYS . . . -65.59 -50.85 63.6 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.135 0.574 . . . . 73.150000000000006 111.45 173.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -73.79 -28.26 61.56 Favored 'General case' 0 N--CA 1.484 1.254 0 CA-C-N 115.907 -0.588 . . . . 53.530000000000001 111.956 176.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.402 ' HB3' ' HA ' ' A' ' 42' ' ' LEU . 23.1 tptm -71.19 -47.38 57.84 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 124.403 1.081 . . . . 63.32 111.585 -176.46 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 75.7 mt -107.34 -0.22 22.6 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.754 0.822 . . . . 71.019999999999996 112.701 -172.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.1 m-20 62.0 33.57 17.2 Favored 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 124.571 1.148 . . . . 73.329999999999998 112.074 -176.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.556 ' O ' ' HA ' ' A' ' 43' ' ' ALA . 45.6 mmtm -126.48 116.22 20.78 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 123.811 0.845 . . . . 73.140000000000001 109.573 -178.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -48.3 148.43 3.26 Favored Pre-proline 0 N--CA 1.502 2.14 0 C-N-CA 123.691 0.797 . . . . 73.319999999999993 112.954 -179.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -53.82 -31.67 63.07 Favored 'Trans proline' 0 C--N 1.387 2.557 0 C-N-CA 123.285 2.657 . . . . 74.510000000000005 115.041 -168.224 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 25.3 m-80 -63.62 -38.87 92.74 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 123.154 0.582 . . . . 74.340000000000003 111.511 178.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -62.41 -43.09 99.65 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 123.971 0.908 . . . . 75.310000000000002 110.229 178.21 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 57.6 t -68.81 -42.68 82.86 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.982 0 CA-C-N 114.261 -1.336 . . . . 75.329999999999998 111.716 -177.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 58.0 m -64.19 -36.36 83.79 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.996 0.918 . . . . 54.009999999999998 112.789 -177.05 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -63.58 -46.8 84.19 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 122.797 0.439 . . . . 72.319999999999993 111.084 175.063 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 17.2 mmt180 -70.67 -27.76 64.27 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 112.708 0.632 . . . . 75.319999999999993 112.708 178.227 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.455 ' HE1' ' SG ' ' A' ' 29' ' ' CYS . 22.8 t80 -56.38 -55.52 32.49 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.078 0.551 . . . . 72.540000000000006 110.735 175.162 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -71.69 -25.99 62.32 Favored 'General case' 0 CA--C 1.554 1.111 0 CA-C-N 115.232 -0.895 . . . . 70.099999999999994 111.637 -178.502 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -72.39 -38.87 68.36 Favored 'General case' 0 CA--C 1.556 1.19 0 C-N-CA 124.818 1.247 . . . . 74.319999999999993 109.684 179.198 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.638 ' HB3' HD21 ' A' ' 26' ' ' LEU . 44.3 mt -73.98 -37.43 64.48 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.758 1.223 . . . . 72.030000000000001 111.716 177.612 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 29.4 mmt -64.7 -28.1 69.37 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 122.909 0.484 . . . . 65.340000000000003 111.436 174.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 57.7 tttm -72.79 -41.97 64.42 Favored 'General case' 0 CA--C 1.557 1.223 0 C-N-CA 123.405 0.682 . . . . 73.239999999999995 110.791 175.103 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 93.0 mt -64.02 -32.81 74.49 Favored 'General case' 0 N--CA 1.497 1.89 0 C-N-CA 123.481 0.713 . . . . 72.109999999999999 111.246 173.125 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 63.8 t80 -61.83 -33.53 74.32 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.42 1.088 . . . . 75.019999999999996 110.972 179.532 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -72.27 -58.36 3.47 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 123.511 0.725 . . . . 64.310000000000002 109.718 169.802 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -178.21 150.15 0.57 Allowed 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 124.635 1.174 . . . . 75.219999999999999 109.466 179.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 69.4 m -70.06 -57.69 4.68 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 122.644 0.378 . . . . 75.239999999999995 111.974 -179.499 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 7.7 mtpm? 60.96 117.8 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.955 0 C-N-CA 125.044 1.338 . . . . 75.140000000000001 113.941 177.204 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 60.6 m -95.02 59.62 2.31 Favored 'General case' 0 N--CA 1.485 1.301 0 N-CA-C 109.238 -0.653 . . . . 72.510000000000005 109.238 169.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 59.8 mtt-85 . . . . . 0 CA--C 1.564 1.502 0 C-N-CA 125.018 1.327 . . . . 62.109999999999999 111.652 -168.272 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 64.4 p . . . . . 0 N--CA 1.49 1.545 0 CA-C-O 120.718 0.294 . . . . 71.109999999999999 110.805 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 74.5 t60 61.53 -86.27 0.02 OUTLIER 'General case' 0 CA--C 1.568 1.668 0 C-N-CA 124.822 1.249 . . . . 71.129999999999995 111.381 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 59.5 ttm -177.17 -66.27 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 124.57 1.148 . . . . 73.299999999999997 109.962 169.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 58.5 tttp 64.82 104.95 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.779 0 C-N-CA 124.76 1.224 . . . . 72.519999999999996 112.436 -178.489 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -97.24 -67.1 0.86 Allowed 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 109.064 -0.717 . . . . 74.25 109.064 174.658 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 45.2 t 57.15 87.63 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.559 1.301 0 C-N-CA 124.958 1.303 . . . . 71.239999999999995 111.711 -174.216 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 3.7 mp -76.37 128.61 37.61 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 N-CA-C 109.075 -0.713 . . . . 72.510000000000005 109.075 174.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -81.41 131.88 35.3 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.179 0.592 . . . . 74.140000000000001 111.075 177.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.462 ' HE3' ' HA ' ' A' ' 9' ' ' LYS . 1.3 tpmt? -93.88 97.88 10.68 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.086 0.554 . . . . 72.209999999999994 110.473 176.42 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 3.4 mppt? -90.52 92.39 8.84 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 122.786 0.434 . . . . 72.120000000000005 110.248 178.072 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -81.09 -130.26 1.03 Allowed Glycine 0 CA--C 1.541 1.683 0 CA-C-N 116.332 -0.395 . . . . 72.209999999999994 112.258 174.273 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -74.04 141.49 45.76 Favored 'General case' 0 N--CA 1.484 1.228 0 CA-C-N 117.055 0.427 . . . . 72.329999999999998 109.987 171.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.1 pp -63.99 92.51 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.559 1.323 0 CA-C-O 121.657 0.742 . . . . 74.299999999999997 111.466 177.231 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 41.9 pt -65.83 -11.81 13.04 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.513 0 C-N-CA 124.539 1.136 . . . . 64.209999999999994 111.884 173.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 2.7 mp -58.85 128.51 19.68 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.885 0 C-N-CA 125.04 1.336 . . . . 74.310000000000002 110.71 175.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 95.2 mt -72.81 87.23 1.28 Allowed 'General case' 0 CA--C 1.547 0.834 0 CA-C-O 121.47 0.652 . . . . 73.25 110.429 175.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 90.3 m95 -79.72 112.78 17.32 Favored 'General case' 0 CA--C 1.542 0.651 0 CA-C-N 114.96 -1.018 . . . . 74.340000000000003 109.907 175.005 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 37.7 p -103.53 167.37 9.85 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.262 0.625 . . . . 62.409999999999997 111.597 -175.22 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.447 ' O ' ' HB2' ' A' ' 23' ' ' ARG . 16.5 ptm180 -62.28 -21.49 65.26 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-N 115.268 -0.878 . . . . 70.540000000000006 112.303 174.575 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -77.66 -45.21 25.67 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 123.721 0.808 . . . . 71.310000000000002 110.842 174.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.471 ' HA ' HD22 ' A' ' 46' ' ' LEU . 76.7 m-20 -60.26 -58.84 6.8 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.051 0.54 . . . . 62.240000000000002 112.079 -176.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -66.87 -30.73 70.97 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 123.498 0.719 . . . . 75.329999999999998 111.704 -172.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.447 ' HB2' ' O ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -60.77 -49.61 76.82 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.993 0.917 . . . . 72.319999999999993 111.448 175.814 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 89.2 t -69.95 -32.18 50.62 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 CA-C-N 114.587 -1.188 . . . . 74.409999999999997 110.889 -179.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.403 ' HA ' HD13 ' A' ' 42' ' ' LEU . 66.4 mt -56.3 -56.28 14.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 C-N-CA 122.491 0.317 . . . . 54.450000000000003 110.7 172.852 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 96.0 mt -58.08 -45.4 87.22 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.317 0.647 . . . . 74.530000000000001 112.472 179.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 32.2 tp -64.92 -50.05 67.99 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.094 0.557 . . . . 71.230000000000004 112.274 -174.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -78.41 -23.26 46.81 Favored 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 123.033 0.533 . . . . 74.519999999999996 112.42 -178.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.491 ' HA ' HG21 ' A' ' 38' ' ' THR . 53.3 t -73.04 -31.46 64.45 Favored 'General case' 0 N--CA 1.498 1.93 0 C-N-CA 122.933 0.493 . . . . 73.109999999999999 111.549 177.26 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 28.9 mm-40 -87.08 7.4 28.04 Favored 'General case' 0 N--CA 1.486 1.363 0 CA-C-O 120.668 0.27 . . . . 54.119999999999997 111.259 173.537 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.8 ttmp? -110.03 -53.27 2.69 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 123.871 0.868 . . . . 73.510000000000005 111.233 -178.424 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -100.86 9.14 42.7 Favored 'General case' 0 N--CA 1.497 1.889 0 C-N-CA 123.583 0.753 . . . . 73.430000000000007 112.22 177.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 87.88 160.39 35.62 Favored Glycine 0 CA--C 1.544 1.881 0 CA-C-O 119.944 -0.365 . . . . 74.340000000000003 113.75 -178.606 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.439 ' HA ' ' SG ' ' A' ' 29' ' ' CYS . 53.2 Cg_endo -84.9 40.51 0.84 Allowed 'Trans proline' 0 C--N 1.37 1.687 0 C-N-CA 123.247 2.631 . . . . 61.210000000000001 113.691 -177.743 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 47.4 m -107.43 171.64 7.27 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 123.614 0.765 . . . . 51.219999999999999 112.384 -175.03 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 88.7 p -61.58 -24.27 66.55 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 123.789 0.835 . . . . 74.120000000000005 112.776 -179.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 23.6 ttmm -49.66 -45.27 48.41 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 124.471 1.108 . . . . 74.439999999999998 111.68 170.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.491 HG21 ' HA ' ' A' ' 29' ' ' CYS . 17.7 m -88.35 -33.97 17.77 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-N 114.806 -1.088 . . . . 74.349999999999994 110.9 -173.758 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 22.5 m-85 -67.79 -35.48 78.74 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.004 0.521 . . . . 75.25 112.251 -179.813 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -72.2 -36.43 69.19 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 121.387 0.613 . . . . 42.240000000000002 111.411 174.37 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 20.9 t80 -59.69 -49.43 77.77 Favored 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 124.236 1.014 . . . . 73.010000000000005 111.463 172.361 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.483 ' HB2' HG11 ' A' ' 53' ' ' VAL . 59.8 mt -70.52 -26.28 63.51 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 124.308 1.043 . . . . 72.209999999999994 112.008 178.698 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.1 -56.32 22.27 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 122.892 0.477 . . . . 74.310000000000002 111.327 174.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -66.57 -28.64 68.69 Favored 'General case' 0 N--CA 1.485 1.296 0 N-CA-C 112.363 0.505 . . . . 62.530000000000001 112.363 178.143 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 17.5 tptp -69.96 -45.79 66.65 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.114 0.565 . . . . 74.019999999999996 112.104 178.209 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.555 ' HB2' ' HG2' ' A' ' 48' ' ' LYS . 28.8 mt -99.09 0.94 44.67 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.26 0.624 . . . . 73.120000000000005 112.153 -173.605 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 25.8 t70 69.45 26.98 5.06 Favored 'General case' 0 CA--C 1.569 1.709 0 C-N-CA 125.115 1.366 . . . . 74.349999999999994 111.831 -178.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.555 ' HG2' ' HB2' ' A' ' 46' ' ' LEU . 63.2 mmtt -101.8 -174.89 2.7 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 123.682 0.793 . . . . 45.439999999999998 111.458 179.258 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.435 HD22 ' N ' ' A' ' 49' ' ' ASN . 0.8 OUTLIER -100.13 151.35 37.49 Favored Pre-proline 0 N--CA 1.49 1.557 0 C-N-CA 123.821 0.848 . . . . 71.219999999999999 109.285 167.909 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -61.83 -33.53 84.58 Favored 'Trans proline' 0 C--N 1.382 2.306 0 C-N-CA 122.721 2.281 . . . . 74.049999999999997 113.35 -176.102 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 75.5 m-20 -65.99 -39.19 90.1 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 123.666 0.786 . . . . 70.329999999999998 111.538 177.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -69.42 -38.72 78.02 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 123.489 0.716 . . . . 74.400000000000006 111.339 -179.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.483 HG11 ' HB2' ' A' ' 42' ' ' LEU . 95.0 t -65.42 -41.42 91.07 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 C-N-CA 123.436 0.694 . . . . 60.530000000000001 110.872 174.382 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 33.8 t -60.05 -42.33 94.23 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.563 0.745 . . . . 53.229999999999997 111.311 176.491 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -64.81 -49.6 70.01 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 115.837 -0.619 . . . . 75.219999999999999 111.547 175.024 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.47 ' O ' ' HB2' ' A' ' 60' ' ' LEU . 3.3 tpm_? -57.21 -41.98 80.43 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 122.998 0.519 . . . . 73.230000000000004 111.912 -178.002 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -59.07 -54.92 41.58 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.983 0.913 . . . . 72.329999999999998 112.24 177.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 21.0 mt-30 -73.35 -28.9 62.3 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.012 0.525 . . . . 74.450000000000003 111.95 -173.302 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.51 ' O ' ' HG ' ' A' ' 63' ' ' LEU . 56.5 mt-30 -64.72 -46.14 83.55 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 122.947 0.499 . . . . 71.510000000000005 110.003 167.011 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.47 ' HB2' ' O ' ' A' ' 56' ' ' ARG . 0.8 OUTLIER -60.38 -38.35 83.66 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 124.256 1.022 . . . . 71.329999999999998 111.238 -177.6 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 21.7 mmt -72.63 -30.26 64.16 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.276 0.631 . . . . 55.140000000000001 111.869 176.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 53.0 tptt -73.77 -32.74 63.94 Favored 'General case' 0 CA--C 1.558 1.274 0 C-N-CA 123.114 0.566 . . . . 73.400000000000006 111.105 174.591 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 59' ' ' GLN . 80.4 mt -71.96 -42.16 66.9 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 123.84 0.856 . . . . 74.510000000000005 110.5 175.544 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 53.0 t80 -68.72 -26.47 65.28 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 124.494 1.118 . . . . 72.439999999999998 110.649 176.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -71.4 -59.19 2.89 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 123.607 0.763 . . . . 72.010000000000005 110.69 175.337 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -159.67 122.78 3.57 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.493 0.717 . . . . 71.040000000000006 110.417 -177.757 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 53.7 m 69.3 107.92 0.06 Allowed 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 125.171 1.389 . . . . 52.140000000000001 112.432 176.777 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.459 ' HA ' ' HB3' ' A' ' 63' ' ' LEU . 97.2 mttt -86.4 153.44 21.91 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 123.592 0.757 . . . . 70.030000000000001 112.017 178.033 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 46.2 t -84.43 128.93 34.87 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.165 0.586 . . . . 44.130000000000003 111.767 -177.123 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 36.0 ttt180 . . . . . 0 CA--C 1.568 1.665 0 C-N-CA 123.599 0.76 . . . . 72.129999999999995 111.698 175.157 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 90.3 p . . . . . 0 N--CA 1.49 1.575 0 CA-C-O 120.733 0.301 . . . . 54.409999999999997 111.3 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 61.7 m-70 -91.83 51.57 1.86 Allowed 'General case' 0 N--CA 1.49 1.565 0 CA-C-O 121.641 0.734 . . . . 73.120000000000005 109.921 178.126 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 26.1 ttt -73.78 113.13 10.57 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 124.527 1.131 . . . . 62.439999999999998 112.053 -168.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -112.46 94.0 4.71 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 124.073 0.949 . . . . 64.209999999999994 110.764 177.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -82.75 110.44 17.79 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.145 0.578 . . . . 72.310000000000002 110.57 177.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 43.8 t -72.66 86.64 0.43 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.116 0 CA-C-O 121.729 0.776 . . . . 52.130000000000003 109.889 179.379 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 11.2 tt -98.46 104.74 16.34 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.178 0 CA-C-N 115.244 -0.889 . . . . 74.310000000000002 111.161 -175.245 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 50.3 mtmt -123.46 62.71 1.03 Allowed 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.865 0.866 . . . . 75.25 109.126 174.847 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -84.87 -20.08 31.37 Favored 'General case' 0 N--CA 1.485 1.284 0 CA-C-N 115.189 -0.914 . . . . 74.25 111.7 178.523 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 64.5 tttm -155.72 125.97 6.68 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.892 0.877 . . . . 64.140000000000001 109.686 -174.407 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -75.07 77.2 1.17 Allowed Glycine 0 C--N 1.348 1.244 0 O-C-N 123.378 0.424 . . . . 60.509999999999998 113.331 179.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -107.12 154.48 21.1 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.731 0.813 . . . . 73.109999999999999 109.905 177.462 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.6 mp -73.91 -31.57 31.17 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 C-N-CA 123.393 0.677 . . . . 32.32 111.386 -174.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 61.2 mt 63.18 80.8 0.07 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.064 0 C-N-CA 124.712 1.205 . . . . 75.230000000000004 109.64 -171.325 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.629 HD13 ' HA ' ' A' ' 52' ' ' GLN . 52.4 mt 64.01 106.02 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.188 0 C-N-CA 125.239 1.416 . . . . 75.209999999999994 111.587 -176.207 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 48.2 tp -73.36 113.31 10.3 Favored 'General case' 0 CA--C 1.551 1.018 0 CA-C-O 121.282 0.563 . . . . 64.310000000000002 112.283 -173.812 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . 0.549 ' HE1' ' HG3' ' A' ' 56' ' ' ARG . 98.6 m95 -126.2 173.97 8.86 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.715 1.206 . . . . 62.420000000000002 110.434 171.502 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 14.0 p -103.8 160.91 14.38 Favored 'General case' 0 N--CA 1.486 1.328 0 N-CA-C 108.382 -0.97 . . . . 61.25 108.382 164.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 36.7 ptt-85 -57.0 -26.05 59.58 Favored 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 123.309 0.644 . . . . 73.310000000000002 111.886 177.352 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.438 ' O ' HG23 ' A' ' 24' ' ' VAL . 22.3 m-80 -75.52 -37.25 60.21 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.016 0.927 . . . . 75.450000000000003 110.911 -179.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -68.37 -47.71 66.68 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 112.961 0.726 . . . . 64.219999999999999 112.961 -177.487 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -65.54 -30.36 71.1 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 120.872 0.368 . . . . 72.030000000000001 111.38 176.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 76.6 ttt180 -62.32 -44.29 96.84 Favored 'General case' 0 N--CA 1.484 1.226 0 CA-C-N 116.421 -0.354 . . . . 73.040000000000006 111.053 168.717 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 20' ' ' ASN . 68.1 t -63.17 -34.28 65.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 C-N-CA 123.351 0.66 . . . . 74.030000000000001 111.169 176.676 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 88.0 mt -61.32 -44.03 97.7 Favored 'Isoleucine or valine' 0 CA--C 1.564 1.502 0 C-N-CA 122.581 0.353 . . . . 72.230000000000004 111.222 173.762 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.442 ' HG ' HD13 ' A' ' 60' ' ' LEU . 94.0 mt -72.19 -28.53 63.26 Favored 'General case' 0 N--CA 1.491 1.593 0 C-N-CA 123.609 0.764 . . . . 72.140000000000001 112.537 174.644 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 47.5 tp -68.01 -52.01 40.53 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 124.211 1.004 . . . . 53.520000000000003 110.325 178.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -76.97 -16.21 59.41 Favored 'General case' 0 CA--C 1.548 0.901 0 CA-C-N 114.922 -1.035 . . . . 64.430000000000007 112.018 178.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 46.1 t -60.61 -32.85 71.97 Favored 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 123.076 0.55 . . . . 74.430000000000007 111.842 167.131 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 9.6 mm100 -91.14 -18.21 24.86 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 122.686 0.394 . . . . 75.010000000000005 110.973 176.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.403 ' HG3' ' NH1' ' A' ' 32' ' ' ARG . 54.1 tptt -74.67 -34.15 62.62 Favored 'General case' 0 CA--C 1.559 1.307 0 C-N-CA 124.09 0.956 . . . . 74.010000000000005 110.801 174.15 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.403 ' NH1' ' HG3' ' A' ' 31' ' ' LYS . 2.8 mpt_? -126.14 -73.77 0.62 Allowed 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 123.81 0.844 . . . . 74.129999999999995 110.561 174.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 150.37 167.33 14.31 Favored Glycine 0 N--CA 1.479 1.566 0 CA-C-O 119.056 -0.858 . . . . 52.219999999999999 111.574 -172.062 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.27 74.89 2.46 Favored 'Trans proline' 0 CA--C 1.564 1.991 0 CA-C-N 120.49 2.145 . . . . 72.409999999999997 112.363 173.138 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 42.5 t -123.38 164.18 19.36 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 124.302 1.041 . . . . 74.519999999999996 111.671 -173.211 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 79.8 p -62.94 -40.62 98.22 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 124.391 1.076 . . . . 64.25 111.621 179.531 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -66.25 -25.76 67.04 Favored 'General case' 0 N--CA 1.485 1.315 0 CA-C-N 115.541 -0.754 . . . . 62.439999999999998 112.072 176.075 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 20.8 m -83.87 -32.24 25.3 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.388 0.675 . . . . 74.510000000000005 110.394 -177.092 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.6 m-85 -61.23 -40.22 93.2 Favored 'General case' 0 CA--C 1.555 1.156 0 C-N-CA 122.84 0.456 . . . . 74.219999999999999 110.304 170.374 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -74.71 -34.72 62.66 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.04 0.936 . . . . 73.299999999999997 111.957 177.479 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 67.9 t80 -64.84 -46.26 82.65 Favored 'General case' 0 N--CA 1.49 1.537 0 C-N-CA 124.19 0.996 . . . . 73.540000000000006 110.989 177.19 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.476 ' HB2' HG11 ' A' ' 53' ' ' VAL . 42.7 mt -73.61 -25.61 60.41 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.417 1.087 . . . . 53.409999999999997 112.259 175.42 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.91 -42.64 94.56 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-O 120.872 0.368 . . . . 72.120000000000005 110.576 171.027 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -71.07 -36.93 72.45 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.682 0.793 . . . . 51.420000000000002 112.133 176.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 9.0 tmtm? -77.1 -41.62 41.37 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.908 0.883 . . . . 53.210000000000001 111.583 -174.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.434 ' HB3' ' HZ3' ' A' ' 17' ' ' TRP . 83.8 mt -99.6 -1.6 37.74 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.482 0.713 . . . . 53.340000000000003 112.02 -176.328 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 36.7 t70 55.58 65.2 1.53 Allowed 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 124.868 1.267 . . . . 73.420000000000002 112.815 179.43 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.44 ' HG3' ' CH2' ' A' ' 17' ' ' TRP . 68.1 mmtt -141.48 175.86 9.34 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 124.864 1.265 . . . . 51.240000000000002 109.922 172.643 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 65.2 m-80 -75.23 149.59 84.72 Favored Pre-proline 0 CA--C 1.559 1.291 0 N-CA-C 110.158 -0.312 . . . . 74.109999999999999 110.158 168.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -54.86 -29.66 64.39 Favored 'Trans proline' 0 C--N 1.387 2.571 0 C-N-CA 122.998 2.465 . . . . 64.099999999999994 114.482 -178.256 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -65.16 -41.02 95.08 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 123.612 0.765 . . . . 74.219999999999999 111.561 176.539 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.629 ' HA ' HD13 ' A' ' 15' ' ' ILE . 76.7 mm-40 -64.89 -36.79 85.51 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 123.427 0.691 . . . . 72.430000000000007 111.179 -176.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.476 HG11 ' HB2' ' A' ' 42' ' ' LEU . 82.4 t -72.51 -50.78 32.51 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.951 0 CA-C-N 115.161 -0.927 . . . . 71.099999999999994 111.045 172.391 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 46.6 t -60.16 -49.47 77.49 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 124.388 1.075 . . . . 62.520000000000003 112.884 -169.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.45 ' O ' ' HG2' ' A' ' 59' ' ' GLN . 31.4 mm-40 -56.51 -47.71 78.76 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.412 0.685 . . . . 62.049999999999997 111.833 177.703 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.549 ' HG3' ' HE1' ' A' ' 17' ' ' TRP . 10.1 mmm180 -71.91 -28.15 63.29 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.731 0.812 . . . . 74.200000000000003 112.843 -179.125 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -66.87 -41.29 87.51 Favored 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 108.716 -0.846 . . . . 65.549999999999997 108.716 173.302 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.407 ' O ' ' HG3' ' A' ' 62' ' ' LYS . 53.4 mt-30 -69.33 -29.65 67.53 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 115.356 -0.838 . . . . 72.239999999999995 111.642 175.826 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.45 ' HG2' ' O ' ' A' ' 55' ' ' GLU . 13.3 mm100 -66.99 -41.58 86.5 Favored 'General case' 0 N--CA 1.49 1.57 0 CA-C-O 121.203 0.525 . . . . 72.140000000000001 109.832 176.071 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.442 HD13 ' HG ' ' A' ' 26' ' ' LEU . 69.2 mt -59.57 -43.76 93.5 Favored 'General case' 0 CA--C 1.551 1.003 0 CA-C-N 114.989 -1.005 . . . . 74.439999999999998 111.059 174.225 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 23.6 mmt -65.78 -29.89 70.45 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 123.266 0.626 . . . . 64.319999999999993 112.325 176.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.407 ' HG3' ' O ' ' A' ' 58' ' ' GLN . 95.9 mttt -70.39 -31.91 69.33 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 123.392 0.677 . . . . 74.129999999999995 111.094 173.396 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 85.6 mt -67.6 -39.6 84.78 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.024 0.529 . . . . 70.230000000000004 111.082 174.381 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -72.92 -31.18 64.46 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 123.129 0.572 . . . . 63.240000000000002 111.861 174.435 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 2.6 tm-20 -60.3 -58.43 8.55 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.654 0.781 . . . . 73.409999999999997 111.094 -179.411 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.68 -45.01 22.33 Favored 'General case' 0 CA--C 1.556 1.177 0 C-N-CA 122.748 0.419 . . . . 74.109999999999999 110.078 -179.834 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 23.2 t 65.75 27.48 11.19 Favored 'General case' 0 N--CA 1.497 1.917 0 C-N-CA 124.352 1.061 . . . . 71.239999999999995 111.571 -176.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -74.36 90.76 2.16 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-O 121.167 0.508 . . . . 75.430000000000007 109.885 176.067 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 66.0 m -86.58 87.67 7.49 Favored 'General case' 0 N--CA 1.477 0.88 0 CA-C-O 121.273 0.559 . . . . 64.349999999999994 110.316 179.545 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.41 ' HG3' ' H ' ' A' ' 70' ' ' ARG . 0.3 OUTLIER . . . . . 0 CA--C 1.574 1.899 0 C-N-CA 124.201 1.0 . . . . 74.230000000000004 113.085 -178.442 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 45.0 t . . . . . 0 N--CA 1.491 1.59 0 N-CA-C 110.888 -0.041 . . . . 63.350000000000001 110.888 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' HIS . . . . . . . . . . . . . 77.9 m-70 -70.75 112.29 6.85 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 122.908 0.483 . . . . 64.349999999999994 111.356 177.114 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' MET . . . . . . . . . . . . . 27.3 ttt -163.64 -65.38 0.04 OUTLIER 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.048 0.939 . . . . 72.329999999999998 109.532 176.365 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER 61.17 98.76 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 124.637 1.175 . . . . 72.430000000000007 112.626 176.402 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 80.4 m-20 -70.02 -31.67 69.45 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 122.87 0.468 . . . . 53.140000000000001 110.844 173.056 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 98.2 t 60.65 98.68 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.212 0 C-N-CA 124.935 1.294 . . . . 72.140000000000001 113.029 174.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 9.9 tt -70.85 -52.33 28.9 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.25 0 N-CA-C 109.571 -0.529 . . . . 73.040000000000006 109.571 167.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 58.1 mtpt -144.99 160.93 40.56 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 125.059 1.344 . . . . 71.420000000000002 109.116 176.593 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -160.27 -40.08 0.05 Allowed 'General case' 0 N--CA 1.496 1.835 0 CA-C-N 118.25 0.477 . . . . 73.129999999999995 112.266 -173.269 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.84 150.71 44.2 Favored 'General case' 0 N--CA 1.487 1.418 0 N-CA-C 113.277 0.843 . . . . 62.32 113.277 -172.235 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 137.66 175.22 13.74 Favored Glycine 0 N--CA 1.475 1.26 0 CA-C-N 115.533 -0.758 . . . . 55.340000000000003 112.75 -174.345 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 -90.14 93.44 9.37 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 122.868 0.467 . . . . 73.219999999999999 111.421 178.318 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.3 mp -77.49 127.72 38.22 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 N-CA-C 108.234 -1.024 . . . . 72.340000000000003 108.234 171.639 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 3.1 mp -78.49 85.06 1.04 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.871 0 N-CA-C 108.565 -0.902 . . . . 50.43 108.565 179.808 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.61 HG13 ' HG2' ' A' ' 52' ' ' GLN . 48.5 mm 72.81 142.9 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.564 1.519 0 C-N-CA 125.414 1.486 . . . . 74.319999999999993 112.987 176.378 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -70.89 84.28 0.67 Allowed 'General case' 0 CA--C 1.559 1.31 0 C-N-CA 124.43 1.092 . . . . 74.030000000000001 110.262 -178.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' TRP . . . . . . . . . . . . . 80.8 m95 -98.12 115.06 27.5 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.462 0.705 . . . . 74.230000000000004 111.434 179.479 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 58.2 p -107.58 166.11 10.92 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.333 0.653 . . . . 44.520000000000003 110.949 177.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 17.1 ptp180 -57.91 -21.16 42.09 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 124.198 0.999 . . . . 72.109999999999999 112.276 174.015 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -76.58 -46.04 27.86 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 124.084 0.954 . . . . 60.030000000000001 110.724 174.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 39.2 m-20 -59.7 -57.03 14.67 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.25 0.62 . . . . 75.219999999999999 111.735 178.685 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.629 ' HB2' HD21 ' A' ' 60' ' ' LEU . 2.6 p30 -64.97 -31.74 73.13 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 113.209 0.818 . . . . 73.299999999999997 113.209 -174.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 48.2 ttt180 -62.28 -42.11 99.06 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 122.893 0.477 . . . . 73.519999999999996 111.018 175.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.463 ' HB ' HD21 ' A' ' 46' ' ' LEU . 92.7 t -71.36 -33.09 48.95 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.24 0 C-N-CA 123.455 0.702 . . . . 72.109999999999999 111.487 177.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 94.5 mt -57.65 -57.38 10.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 CA-C-O 120.886 0.374 . . . . 64.310000000000002 110.278 172.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.436 ' HG ' HD13 ' A' ' 60' ' ' LEU . 90.6 mt -61.89 -33.28 73.94 Favored 'General case' 0 N--CA 1.482 1.129 0 CA-C-N 115.636 -0.711 . . . . 71.209999999999994 112.174 178.656 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 56.0 tp -61.76 -54.46 42.08 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.803 0.841 . . . . 71.319999999999993 111.533 179.047 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.524 ' HA ' ' HB3' ' A' ' 31' ' ' LYS . 59.3 mm-40 -75.13 -22.94 57.85 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 113.045 0.757 . . . . 75.230000000000004 113.045 -178.679 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 89.6 m -69.83 -30.13 67.56 Favored 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 122.775 0.43 . . . . 54.109999999999999 111.307 171.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -91.92 -20.38 21.47 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 123.346 0.658 . . . . 71.25 111.882 173.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.524 ' HB3' ' HA ' ' A' ' 28' ' ' GLU . 58.8 tptt -80.66 -67.21 0.79 Allowed 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.641 0.777 . . . . 73.099999999999994 110.545 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 45.2 mtt85 -92.51 -40.38 10.85 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.03 0.932 . . . . 72.030000000000001 111.74 -178.34 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 138.48 163.07 9.43 Favored Glycine 0 N--CA 1.481 1.658 0 CA-C-O 119.528 -0.596 . . . . 52.140000000000001 112.556 -178.384 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -83.2 36.37 0.61 Allowed 'Trans proline' 0 CA--C 1.561 1.858 0 C-N-CA 123.017 2.478 . . . . 71.040000000000006 113.815 179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 79.1 p -80.59 161.44 24.73 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.589 0.756 . . . . 75.239999999999995 111.732 -177.745 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 99.0 p -67.05 -23.77 65.91 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.04 0.536 . . . . 72.109999999999999 111.587 174.745 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -69.8 -32.04 70.28 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.531 0.732 . . . . 65.129999999999995 111.492 173.725 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 86.3 m -78.04 -37.17 47.45 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.048 0.539 . . . . 72.310000000000002 109.636 178.228 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 -64.7 -32.08 73.59 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.405 0.682 . . . . 73.420000000000002 111.39 172.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.62 -39.51 88.36 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 123.415 0.686 . . . . 74.329999999999998 111.26 173.527 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -63.05 -49.16 75.67 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.264 0.625 . . . . 72.200000000000003 110.797 172.087 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 77.9 mt -63.62 -23.76 67.52 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 124.79 1.236 . . . . 65.109999999999999 113.032 -179.652 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -61.75 -55.03 34.52 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 123.088 0.555 . . . . 45.5 110.998 170.295 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -72.67 -27.83 62.34 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.586 0.754 . . . . 64.040000000000006 112.351 179.223 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -75.91 -39.02 57.1 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.184 0.993 . . . . 71.319999999999993 111.325 -177.109 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.463 HD21 ' HB ' ' A' ' 24' ' ' VAL . 91.0 mt -106.26 12.75 29.66 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.759 0.824 . . . . 72.540000000000006 112.687 -177.312 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 3.0 p30 51.37 23.95 1.95 Allowed 'General case' 0 N--CA 1.501 2.117 0 C-N-CA 125.548 1.539 . . . . 75.409999999999997 114.09 -174.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -106.82 -175.01 2.67 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 123.615 0.766 . . . . 71.420000000000002 111.565 -178.221 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 47.5 m-80 -96.55 143.84 26.82 Favored Pre-proline 0 N--CA 1.492 1.628 0 C-N-CA 123.084 0.554 . . . . 74.140000000000001 110.431 173.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -66.24 -26.74 48.96 Favored 'Trans proline' 0 C--N 1.379 2.137 0 C-N-CA 122.653 2.235 . . . . 42.240000000000002 113.512 -171.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -71.76 -38.77 70.33 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.46 0.704 . . . . 74.319999999999993 111.32 178.264 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.61 ' HG2' HG13 ' A' ' 15' ' ' ILE . 12.0 mp0 -70.75 -35.14 72.5 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 123.174 0.59 . . . . 73.340000000000003 110.849 176.742 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 86.1 t -62.4 -47.36 93.37 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.217 0 C-N-CA 123.375 0.67 . . . . 61.509999999999998 111.26 174.475 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 90.9 p -65.67 -41.7 92.18 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 123.35 0.66 . . . . 74.109999999999999 112.161 -177.239 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -64.92 -48.97 72.25 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 122.675 0.39 . . . . 72.420000000000002 111.63 177.018 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.46 ' NH1' ' HB3' ' A' ' 22' ' ' ASP . 0.0 OUTLIER -70.08 -23.98 63.16 Favored 'General case' 0 CA--C 1.561 1.368 0 C-N-CA 123.313 0.645 . . . . 72.530000000000001 111.215 -177.079 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.484 ' HA ' HD12 ' A' ' 60' ' ' LEU . 23.9 t80 -61.13 -49.29 77.86 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 123.979 0.912 . . . . 75.099999999999994 111.556 170.71 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -73.88 -24.42 59.73 Favored 'General case' 0 N--CA 1.48 1.029 0 CA-C-N 115.465 -0.789 . . . . 71.099999999999994 111.143 -178.801 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLN . . . . . 0.408 ' O ' ' HG ' ' A' ' 63' ' ' LEU . 14.5 mm100 -72.35 -32.81 66.79 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.58 0.752 . . . . 75.239999999999995 111.102 171.509 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.629 HD21 ' HB2' ' A' ' 22' ' ' ASP . 15.3 mt -58.58 -55.54 33.79 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.415 0.686 . . . . 72.299999999999997 111.142 173.218 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 27.9 mmt -63.4 -31.06 72.12 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.015 0.526 . . . . 72.030000000000001 112.018 178.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -64.01 -46.37 84.82 Favored 'General case' 0 CA--C 1.556 1.209 0 C-N-CA 123.498 0.719 . . . . 64.430000000000007 111.389 174.418 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' A' ' 59' ' ' GLN . 97.3 mt -72.02 -41.12 67.91 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 123.496 0.718 . . . . 65.310000000000002 112.09 -179.115 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -67.96 -16.2 63.95 Favored 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 123.367 0.667 . . . . 70.439999999999998 112.631 -179.294 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -66.49 -33.6 76.05 Favored 'General case' 0 CA--C 1.561 1.397 0 C-N-CA 122.484 0.314 . . . . 64.140000000000001 111.09 170.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 64.4 pttt -114.21 7.68 16.63 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 112.685 0.624 . . . . 73.420000000000002 112.685 178.611 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 58.6 m -74.98 128.55 35.83 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 122.025 -0.422 . . . . 64.25 110.896 175.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 90.9 mttt -74.55 104.86 5.41 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.573 0.749 . . . . 64.140000000000001 110.562 179.844 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' CYS . . . . . . . . . . . . . 76.6 m -79.02 16.66 0.88 Allowed 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 123.906 0.883 . . . . 64.430000000000007 113.234 -176.098 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 55.2 ttt180 . . . . . 0 CA--C 1.558 1.287 0 C-N-CA 123.944 0.898 . . . . 73.019999999999996 109.323 176.461 . . . . . . . . 0 0 . 1 stop_ save_